In this tutorial, we will fold a protein structure using a very simple algorithm in PyRosetta, and compare the folded structure with the solved crystal structure of the protein.
We begin by importing the relevant libraries from Python. If running the following cell produces any errors or warnings, make sure you have followed all the steps in the "Setting up Pyrosetta" section.
import os
import glob
import shutil
import numpy as np
import pandas as pd
import nglview as ngl
import pyrosetta as prs
prs.init()
from pyrosetta import rosetta
PyRosetta-4 2020 [Rosetta PyRosetta4.conda.linux.CentOS.python37.Release 2020.08+release.cb1cabafd7463ab703f6abf5efa33d2707b85924 2020-02-20T07:29:09] retrieved from: http://www.pyrosetta.org (C) Copyright Rosetta Commons Member Institutions. Created in JHU by Sergey Lyskov and PyRosetta Team. core.init: {0} Checking for fconfig files in pwd and ./rosetta/flags core.init: {0} Rosetta version: PyRosetta4.conda.linux.CentOS.python37.Release r247 2020.08+release.cb1caba cb1cabafd7463ab703f6abf5efa33d2707b85924 http://www.pyrosetta.org 2020-02-20T07:29:09 core.init: {0} command: PyRosetta -ex1 -ex2aro -database /home/perry/miniconda3/envs/my_env/lib/python3.7/site-packages/pyrosetta/database basic.random.init_random_generator: {0} 'RNG device' seed mode, using '/dev/urandom', seed=-996830844 seed_offset=0 real_seed=-996830844 thread_index=0 basic.random.init_random_generator: {0} RandomGenerator:init: Normal mode, seed=-996830844 RG_type=mt19937
scorefxn_low = prs.create_score_function('score3')
scorefxn_high = prs.get_fa_scorefxn()
basic.io.database: {0} Database file opened: scoring/score_functions/EnvPairPotential/env_log.txt
basic.io.database: {0} Database file opened: scoring/score_functions/EnvPairPotential/cbeta_den.txt
basic.io.database: {0} Database file opened: scoring/score_functions/EnvPairPotential/pair_log.txt
basic.io.database: {0} Database file opened: scoring/score_functions/EnvPairPotential/cenpack_log.txt
basic.io.database: {0} Database file opened: scoring/score_functions/SecondaryStructurePotential/phi.theta.36.HS.resmooth
basic.io.database: {0} Database file opened: scoring/score_functions/SecondaryStructurePotential/phi.theta.36.SS.resmooth
core.scoring.ScoreFunctionFactory: {0} SCOREFUNCTION: ref2015
core.scoring.etable: {0} Starting energy table calculation
core.scoring.etable: {0} smooth_etable: changing atr/rep split to bottom of energy well
core.scoring.etable: {0} smooth_etable: spline smoothing lj etables (maxdis = 6)
core.scoring.etable: {0} smooth_etable: spline smoothing solvation etables (max_dis = 6)
core.scoring.etable: {0} Finished calculating energy tables.
basic.io.database: {0} Database file opened: scoring/score_functions/hbonds/ref2015_params/HBPoly1D.csv
basic.io.database: {0} Database file opened: scoring/score_functions/hbonds/ref2015_params/HBFadeIntervals.csv
basic.io.database: {0} Database file opened: scoring/score_functions/hbonds/ref2015_params/HBEval.csv
basic.io.database: {0} Database file opened: scoring/score_functions/hbonds/ref2015_params/DonStrength.csv
basic.io.database: {0} Database file opened: scoring/score_functions/hbonds/ref2015_params/AccStrength.csv
core.chemical.GlobalResidueTypeSet: {0} Finished initializing fa_standard residue type set. Created 980 residue types
core.chemical.GlobalResidueTypeSet: {0} Total time to initialize 1.44822 seconds.
basic.io.database: {0} Database file opened: scoring/score_functions/rama/fd/all.ramaProb
basic.io.database: {0} Database file opened: scoring/score_functions/rama/fd/prepro.ramaProb
basic.io.database: {0} Database file opened: scoring/score_functions/omega/omega_ppdep.all.txt
basic.io.database: {0} Database file opened: scoring/score_functions/omega/omega_ppdep.gly.txt
basic.io.database: {0} Database file opened: scoring/score_functions/omega/omega_ppdep.pro.txt
basic.io.database: {0} Database file opened: scoring/score_functions/omega/omega_ppdep.valile.txt
basic.io.database: {0} Database file opened: scoring/score_functions/P_AA_pp/P_AA
basic.io.database: {0} Database file opened: scoring/score_functions/P_AA_pp/P_AA_n
core.scoring.P_AA: {0} shapovalov_lib::shap_p_aa_pp_smooth_level of 1( aka low_smooth ) got activated.
basic.io.database: {0} Database file opened: scoring/score_functions/P_AA_pp/shapovalov/10deg/kappa131/a20.prop
native_pose = prs.pose_from_pdb('data/1BL0/1BL0_chainA.pdb')
core.import_pose.import_pose: {0} File 'data/1BL0/1BL0_chainA.pdb' automatically determined to be of type PDB
# generate a random aa sequence with the same aa distribution
N = 50
# taken from https://web.expasy.org/protscale/pscale/A.A.Swiss-Prot.html
aa_freqs = {
'A': 8.25,
'R': 5.53,
'N': 4.06,
'D': 5.45,
'C': 1.37,
'Q': 3.93,
'E': 6.75,
'G': 7.07,
'H': 2.27,
'I': 5.96,
'L': 9.66,
'K': 5.84,
'M': 2.42,
'F': 3.86,
'P': 4.70,
'S': 6.56,
'T': 5.34,
'W': 1.08,
'Y': 2.92,
'V': 6.87
}
s = ""
for aa, freq in aa_freqs.items():
for i in range(int(freq * 20)):
s += aa
sequence = ""
indices = np.random.randint(0, len(s) - 1, N)
for idx in indices:
sequence += s[idx]
print(sequence)
STDTLRKKNAGLETAALNHGGDHTTVALVNFHGNRGALIENLKGAEMSQS
We can check the amino acid sequence of the structure with a very simple command.
native_pose.sequence()
'DAITIHSILDWIEDNLESPLSLEKVSERSGYSKWHLQRMFKKETGHSLGQYIRSRKMTEIAQKLKESNEPILYLAERYGFESQQTLTRTFKNYFDVPPHKYRMTNMQGESRFLHPL'
We can also assign the correct secondary structure.
DSSP = prs.rosetta.protocols.moves.DsspMover()
DSSP.apply(native_pose) # populates the pose's Pose.secstruct
protocols.DsspMover: {0} LHHHHHHHHHHHHLLLLLLLLLHHHHHHLLLLHHHHHHHHHHHHLLLHHHHHHHHHHHHHHHHHHHLLLLHHHHHHHHLLLLHHHHHHHHHHHHLLLHHHHHLLLLLLLLLLLLLL
Let's view more information about the first residue of the protein.
print(native_pose.residue(1))
Residue 1: ASP:NtermProteinFull (ASP, D): Base: ASP Properties: POLYMER PROTEIN CANONICAL_AA LOWER_TERMINUS SC_ORBITALS POLAR CHARGED NEGATIVE_CHARGE METALBINDING ALPHA_AA L_AA Variant types: LOWER_TERMINUS_VARIANT Main-chain atoms: N CA C Backbone atoms: N CA C O 1H 2H 3H HA Side-chain atoms: CB CG OD1 OD2 1HB 2HB Atom Coordinates: N : 0.229, 36.012, 74.172 CA : 0.041, 35.606, 75.594 C : -0.096, 36.849, 76.498 O : -0.951, 36.895, 77.382 CB : 1.225, 34.718, 76.092 CG : 2.159, 34.156, 74.999 OD1: 1.688, 33.361, 74.151 OD2: 3.378, 34.497, 75.007 1H : 1.056, 35.74, 73.68 2H : -0.43, 35.723, 73.478 3H : 0.251, 36.981, 73.928 HA : -0.884, 35.037, 75.696 1HB : 1.839, 35.199, 76.854 2HB : 0.67, 33.892, 76.539 Mirrored relative to coordinates in ResidueType: FALSE
pose = prs.pose_from_sequence(sequence)
test_pose = prs.Pose()
test_pose.assign(pose)
test_pose.pdb_info().name('Linearized Pose')
view = ngl.show_rosetta(test_pose)
view.add_ball_and_stick()
view # zoom in to see the atoms!
We will be using the centroid representation to perform rough and fast scoring in the initial stages of the folding algorithm. Later on, we will switch to the full atom represenation to do accurate minimization and get the final structures.
to_centroid = prs.SwitchResidueTypeSetMover('centroid')
to_full_atom = prs.SwitchResidueTypeSetMover('fa_standard')
to_full_atom.apply(test_pose)
print('Full Atom Score:', scorefxn_high(test_pose))
to_centroid.apply(test_pose)
print('Centroid Score:', scorefxn_low(test_pose))
core.util.switchresiduetypeset: {0} [ WARNING ] When switching to a fa_standard ResidueTypeSet: Pose already contains fa_standard ResidueTypes.
basic.io.database: {0} Database file opened: scoring/score_functions/elec_cp_reps.dat
core.scoring.elec.util: {0} Read 40 countpair representative atoms
core.pack.dunbrack.RotamerLibrary: {0} shapovalov_lib_fixes_enable option is true.
core.pack.dunbrack.RotamerLibrary: {0} shapovalov_lib::shap_dun10_smooth_level of 1( aka lowest_smooth ) got activated.
core.pack.dunbrack.RotamerLibrary: {0} Binary rotamer library selected: /home/perry/miniconda3/envs/my_env/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin
core.pack.dunbrack.RotamerLibrary: {0} Using Dunbrack library binary file '/home/perry/miniconda3/envs/my_env/lib/python3.7/site-packages/pyrosetta/database/rotamer/shapovalov/StpDwn_0-0-0/Dunbrack10.lib.bin'.
core.pack.dunbrack.RotamerLibrary: {0} Dunbrack 2010 library took 0.818671 seconds to load from binary
Full Atom Score: 13159.241276890436
core.chemical.GlobalResidueTypeSet: {0} Finished initializing centroid residue type set. Created 62 residue types
core.chemical.GlobalResidueTypeSet: {0} Total time to initialize 0.048479 seconds.
Centroid Score: 208.83575008248903
# here write the code to visualize the centroid only structure and print the information of the 1st residue
view = ngl.show_rosetta(test_pose)
view.add_ball_and_stick()
view # zoom in to see the atoms!
print(native_pose.residue(1))
print(test_pose.residue(1))
Residue 1: ASP:NtermProteinFull (ASP, D): Base: ASP Properties: POLYMER PROTEIN CANONICAL_AA LOWER_TERMINUS SC_ORBITALS POLAR CHARGED NEGATIVE_CHARGE METALBINDING ALPHA_AA L_AA Variant types: LOWER_TERMINUS_VARIANT Main-chain atoms: N CA C Backbone atoms: N CA C O 1H 2H 3H HA Side-chain atoms: CB CG OD1 OD2 1HB 2HB Atom Coordinates: N : 0.229, 36.012, 74.172 CA : 0.041, 35.606, 75.594 C : -0.096, 36.849, 76.498 O : -0.951, 36.895, 77.382 CB : 1.225, 34.718, 76.092 CG : 2.159, 34.156, 74.999 OD1: 1.688, 33.361, 74.151 OD2: 3.378, 34.497, 75.007 1H : 1.056, 35.74, 73.68 2H : -0.43, 35.723, 73.478 3H : 0.251, 36.981, 73.928 HA : -0.884, 35.037, 75.696 1HB : 1.839, 35.199, 76.854 2HB : 0.67, 33.892, 76.539 Mirrored relative to coordinates in ResidueType: FALSE Residue 1: SER:NtermProteinFull (SER, S): Base: SER Properties: POLYMER PROTEIN CANONICAL_AA LOWER_TERMINUS POLAR ALPHA_AA L_AA Variant types: LOWER_TERMINUS_VARIANT Main-chain atoms: N CA C Backbone atoms: N CA C O H Side-chain atoms: CB CEN Atom Coordinates: N : 0, 0, 0 CA : 1.458, 0, 0 C : 2.00885, 1.42017, 0 O : 1.25096, 2.39022, 0 CB : 1.98, -0.769001, -1.198 CEN: 2.00527, -0.962641, -1.70567 H : -0.5, -0.433013, -0.75 Mirrored relative to coordinates in ResidueType: FALSE
# Loading the files with the pre-computed fragmets
long_frag_filename = 'data/random/aat000_09_05.200_v1_3'
long_frag_length = 9
short_frag_filename = 'data/random/aat000_03_05.200_v1_3'
short_frag_length = 3
# Defining parameters of the folding algorithm
long_inserts=5 # How many 9-fragment pieces to insest during the search
short_inserts=10 # How many 3-fragment pieces to insest during the search
kT = 3.0 # Simulated Annealing temperature
cycles = 1000 # How many cycles of Monte Carlo search to run
jobs = 50 # How many trajectories in parallel to compute.
job_output = 'outputs/random/decoy' # The prefix of the filenames to store the results
movemap = prs.MoveMap()
movemap.set_bb(True)
fragset_long = rosetta.core.fragment.ConstantLengthFragSet(long_frag_length, long_frag_filename)
long_frag_mover = rosetta.protocols.simple_moves.ClassicFragmentMover(fragset_long, movemap)
fragset_short = rosetta.core.fragment.ConstantLengthFragSet(short_frag_length, short_frag_filename)
short_frag_mover = rosetta.protocols.simple_moves.ClassicFragmentMover(fragset_short, movemap)
insert_long_frag = prs.RepeatMover(long_frag_mover, long_inserts)
insert_short_frag = prs.RepeatMover(short_frag_mover, short_inserts)
core.fragments.ConstantLengthFragSet: {0} finished reading top 200 9mer fragments from file data/random/aat000_09_05.200_v1_3 core.fragments.ConstantLengthFragSet: {0} finished reading top 200 3mer fragments from file data/random/aat000_03_05.200_v1_3
print("Number of 9mers: ", fragset_long.size())
print("Number of 3mers: ", fragset_short.size())
Number of 9mers: 4400 Number of 3mers: 5600
# Making sure the structure is in centroid-only mode for the search
test_pose.assign(pose)
to_centroid.apply(test_pose)
# Defining what sequence of actions to do between each scoring step
folding_mover = prs.SequenceMover()
folding_mover.add_mover(insert_long_frag)
folding_mover.add_mover(insert_short_frag)
mc = prs.MonteCarlo(test_pose, scorefxn_low, kT)
trial = prs.TrialMover(folding_mover, mc)
# Setting up how many cycles of search to do in each trajectory
folding = prs.RepeatMover(trial, cycles)
fast_relax_mover = prs.rosetta.protocols.relax.FastRelax(scorefxn_high)
protocols.relax.RelaxScriptManager: {0} Reading relax scripts list from database. protocols.relax.RelaxScriptManager: {0} Looking for MonomerRelax2019.txt protocols.relax.RelaxScriptManager: {0} ================== Reading script file: /home/perry/miniconda3/envs/my_env/lib/python3.7/site-packages/pyrosetta/database/sampling/relax_scripts/MonomerRelax2019.txt ================== protocols.relax.RelaxScriptManager: {0} repeat %%nrepeats%% protocols.relax.RelaxScriptManager: {0} coord_cst_weight 1.0 protocols.relax.RelaxScriptManager: {0} scale:fa_rep 0.040 protocols.relax.RelaxScriptManager: {0} repack protocols.relax.RelaxScriptManager: {0} scale:fa_rep 0.051 protocols.relax.RelaxScriptManager: {0} min 0.01 protocols.relax.RelaxScriptManager: {0} coord_cst_weight 0.5 protocols.relax.RelaxScriptManager: {0} scale:fa_rep 0.265 protocols.relax.RelaxScriptManager: {0} repack protocols.relax.RelaxScriptManager: {0} scale:fa_rep 0.280 protocols.relax.RelaxScriptManager: {0} min 0.01 protocols.relax.RelaxScriptManager: {0} coord_cst_weight 0.0 protocols.relax.RelaxScriptManager: {0} scale:fa_rep 0.559 protocols.relax.RelaxScriptManager: {0} repack protocols.relax.RelaxScriptManager: {0} scale:fa_rep 0.581 protocols.relax.RelaxScriptManager: {0} min 0.01 protocols.relax.RelaxScriptManager: {0} coord_cst_weight 0.0 protocols.relax.RelaxScriptManager: {0} scale:fa_rep 1 protocols.relax.RelaxScriptManager: {0} repack protocols.relax.RelaxScriptManager: {0} min 0.00001 protocols.relax.RelaxScriptManager: {0} accept_to_best protocols.relax.RelaxScriptManager: {0} endrepeat
scores = [0] * (jobs + 1)
scores[0] = scorefxn_low(test_pose)
if os.path.isdir(os.path.dirname(job_output)):
shutil.rmtree(os.path.dirname(job_output), ignore_errors=True)
os.makedirs(os.path.dirname(job_output))
jd = prs.PyJobDistributor(job_output, nstruct=jobs, scorefxn=scorefxn_high)
Working on decoy: outputs/random/decoy_34.pdb
counter = 0
while not jd.job_complete:
# a. set necessary variables for the new trajectory
# -reload the starting pose
test_pose.assign(pose)
to_centroid.apply(test_pose)
# -change the pose's PDBInfo.name, for the PyMOL_Observer
counter += 1
test_pose.pdb_info().name(job_output + '_' + str(counter))
# -reset the MonteCarlo object (sets lowest_score to that of test_pose)
mc.reset(test_pose)
#### if you create a custom protocol, you may have additional
#### variables to reset, such as kT
#### if you create a custom protocol, this section will most likely
#### change, many protocols exist as single Movers or can be
#### chained together in a sequence (see above) so you need
#### only apply the final Mover
# b. apply the refinement protocol
folding.apply(test_pose)
####
# c. export the lowest scoring decoy structure for this trajectory
# -recover the lowest scoring decoy structure
mc.recover_low(test_pose)
# -store the final score for this trajectory
# -convert the decoy to fullatom
# the sidechain conformations will all be default,
# normally, the decoys would NOT be converted to fullatom before
# writing them to PDB (since a large number of trajectories would
# be considered and their fullatom score are unnecessary)
# here the fullatom mode is reproduced to make the output easier to
# understand and manipulate, PyRosetta can load in PDB files of
# centroid structures, however you must convert to fullatom for
# nearly any other application
to_full_atom.apply(test_pose)
fast_relax_mover.apply(test_pose)
scores[counter] = scorefxn_high(test_pose)
# -output the fullatom decoy structure into a PDB file
jd.output_decoy(test_pose)
# -export the final structure to PyMOL
test_pose.pdb_info().name(job_output + '_' + str(counter) + '_fa')
protocols.relax.FastRelax: {0} CMD: repeat 14549.7 0 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14549.7 0 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2402.9 0 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 619 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph basic.thread_manager.RosettaThreadManager: {?} Creating a thread pool of 8 threads. basic.thread_manager.RosettaThread: {?} Launching thread 1. basic.thread_manager.RosettaThread: {?} Launching thread 3. basic.thread_manager.RosettaThreadPool: {?} Launched 7 new threads. basic.thread_manager.RosettaThread: {4} Launching thread 4. basic.thread_manager.RosettaThread: {6} Launching thread 6. basic.thread_manager.RosettaThread: {5} Launching thread 5. basic.thread_manager.RosettaThread: {2} Launching thread 2. basic.random.init_random_generator: {1} 'RNG device' seed mode, using '/dev/urandom', seed=-1049107539 seed_offset=0 real_seed=-1049107538 thread_index=1 basic.random.init_random_generator: {1} RandomGenerator:init: Normal mode, seed=-1049107538 RG_type=mt19937 basic.random.init_random_generator: {4} 'RNG device' seed mode, using '/dev/urandom', seed=-1086195942 seed_offset=0 real_seed=-1086195938 thread_index=4 basic.random.init_random_generator: {4} RandomGenerator:init: Normal mode, seed=-1086195938 RG_type=mt19937 basic.random.init_random_generator: {3} 'RNG device' seed mode, using '/dev/urandom', seed=889554414 seed_offset=0 real_seed=889554417 thread_index=3 basic.random.init_random_generator: {3} RandomGenerator:init: Normal mode, seed=889554417 RG_type=mt19937 basic.random.init_random_generator: {6} 'RNG device' seed mode, using '/dev/urandom', seed=1923311294 seed_offset=0 real_seed=1923311300 thread_index=6 basic.random.init_random_generator: {6} RandomGenerator:init: Normal mode, seed=1923311300 RG_type=mt19937 basic.thread_manager.RosettaThread: {7} Launching thread 7. basic.random.init_random_generator: {2} 'RNG device' seed mode, using '/dev/urandom', seed=-1691468736 seed_offset=0 real_seed=-1691468734 thread_index=2 basic.random.init_random_generator: {2} RandomGenerator:init: Normal mode, seed=-1691468734 RG_type=mt19937 basic.random.init_random_generator: {5} 'RNG device' seed mode, using '/dev/urandom', seed=-1446750116 seed_offset=0 real_seed=-1446750111 thread_index=5 basic.random.init_random_generator: {5} RandomGenerator:init: Normal mode, seed=-1446750111 RG_type=mt19937 basic.random.init_random_generator: {7} 'RNG device' seed mode, using '/dev/urandom', seed=-311569617 seed_offset=0 real_seed=-311569610 thread_index=7 basic.random.init_random_generator: {7} RandomGenerator:init: Normal mode, seed=-311569610 RG_type=mt19937 core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 71.4705 0 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 72.8115 0 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 70.5143 0.356412 0.356412 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 70.5143 0.356412 0.356412 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 101.969 0.356412 0.356412 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 592 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 88.2502 0.356412 0.356412 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 89.4639 0.356412 0.356412 0.154 protocols.relax.FastRelax: {0} CMD: min 124.5 4.22456 4.22456 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 124.5 4.22456 4.22456 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 263.857 4.22456 4.22456 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 707 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 254.761 4.22456 4.22456 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 265.569 4.22456 4.22456 0.31955 protocols.relax.FastRelax: {0} CMD: min -7.03561 5.1084 5.1084 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -7.03561 5.1084 5.1084 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1.02638 5.1084 5.1084 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 670 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.997478 5.1084 5.1084 0.55 protocols.relax.FastRelax: {0} CMD: min -8.43189 6.11845 6.11845 0.55 protocols.relax.FastRelax: {0} MRP: 0 -8.43189 -8.43189 6.11845 6.11845 protocols.relax.FastRelax: {0} CMD: accept_to_best -8.43189 6.11845 6.11845 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -8.43189 6.11845 6.11845 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.43189 6.11845 6.11845 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.8872 6.11845 6.11845 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 826 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.0547 6.11845 6.11845 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.7997 6.11845 6.11845 0.02805 protocols.relax.FastRelax: {0} CMD: min -26.2684 6.01447 6.01447 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.2684 6.01447 6.01447 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.16398 6.01447 6.01447 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 755 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -7.73912 6.01447 6.01447 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.68038 6.01447 6.01447 0.154 protocols.relax.FastRelax: {0} CMD: min -20.7122 6.70441 6.70441 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.7122 6.70441 6.70441 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.4826 6.70441 6.70441 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 775 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.6473 6.70441 6.70441 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.0097 6.70441 6.70441 0.31955 protocols.relax.FastRelax: {0} CMD: min -12.8584 6.7122 6.7122 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.8584 6.7122 6.7122 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.34179 6.7122 6.7122 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 729 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.35539 6.7122 6.7122 0.55 protocols.relax.FastRelax: {0} CMD: min -8.7356 8.59959 8.59959 0.55 protocols.relax.FastRelax: {0} MRP: 1 -8.7356 -8.7356 8.59959 8.59959 protocols.relax.FastRelax: {0} CMD: accept_to_best -8.7356 8.59959 8.59959 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -8.7356 8.59959 8.59959 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.7356 8.59959 8.59959 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.4105 8.59959 8.59959 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 749 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.2334 8.59959 8.59959 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.977 8.59959 8.59959 0.02805 protocols.relax.FastRelax: {0} CMD: min -32.097 8.93891 8.93891 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.097 8.93891 8.93891 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7287 8.93891 8.93891 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 776 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.7385 8.93891 8.93891 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7767 8.93891 8.93891 0.154 protocols.relax.FastRelax: {0} CMD: min -23.0205 9.01385 9.01385 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.0205 9.01385 9.01385 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.833 9.01385 9.01385 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 723 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.0328 9.01385 9.01385 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.4263 9.01385 9.01385 0.31955 protocols.relax.FastRelax: {0} CMD: min -15.291 9.03257 9.03257 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.291 9.03257 9.03257 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -5.19122 9.03257 9.03257 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.19351 9.03257 9.03257 0.55 protocols.relax.FastRelax: {0} CMD: min -10.9314 8.64374 8.64374 0.55 protocols.relax.FastRelax: {0} MRP: 2 -10.9314 -10.9314 8.64374 8.64374 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.9314 8.64374 8.64374 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.9314 8.64374 8.64374 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.9314 8.64374 8.64374 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2511 8.64374 8.64374 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 819 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.9588 8.64374 8.64374 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.6702 8.64374 8.64374 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.5283 9.04663 9.04663 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.5283 9.04663 9.04663 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.0083 9.04663 9.04663 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 736 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.8449 9.04663 9.04663 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.4102 9.04663 9.04663 0.154 protocols.relax.FastRelax: {0} CMD: min -25.4704 9.02335 9.02335 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.4704 9.02335 9.02335 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.2518 9.02335 9.02335 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 729 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7777 9.02335 9.02335 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.1041 9.02335 9.02335 0.31955 protocols.relax.FastRelax: {0} CMD: min -16.925 9.03634 9.03634 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.925 9.03634 9.03634 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -5.92223 9.03634 9.03634 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 685 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.70223 9.03634 9.03634 0.55 protocols.relax.FastRelax: {0} CMD: min -13.0255 8.76989 8.76989 0.55 protocols.relax.FastRelax: {0} MRP: 3 -13.0255 -13.0255 8.76989 8.76989 protocols.relax.FastRelax: {0} CMD: accept_to_best -13.0255 8.76989 8.76989 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -13.0255 8.76989 8.76989 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.0255 8.76989 8.76989 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.6322 8.76989 8.76989 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 709 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.1398 8.76989 8.76989 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.9023 8.76989 8.76989 0.02805 protocols.relax.FastRelax: {0} CMD: min -31.5136 8.7165 8.7165 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.5136 8.7165 8.7165 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.30917 8.7165 8.7165 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 682 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.46588 8.7165 8.7165 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.92142 8.7165 8.7165 0.154 protocols.relax.FastRelax: {0} CMD: min -25.7104 8.7551 8.7551 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.7104 8.7551 8.7551 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.8452 8.7551 8.7551 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.9619 8.7551 8.7551 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.4428 8.7551 8.7551 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.077 8.7501 8.7501 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.077 8.7501 8.7501 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.3545 8.7501 8.7501 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.1341 8.7501 8.7501 0.55 protocols.relax.FastRelax: {0} CMD: min -12.5886 8.80339 8.80339 0.55 protocols.relax.FastRelax: {0} MRP: 4 -12.5886 -13.0255 8.76989 8.76989 protocols.relax.FastRelax: {0} CMD: accept_to_best -12.5886 8.80339 8.80339 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -12.5886 8.80339 8.80339 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_20.pdb protocols.relax.FastRelax: {0} CMD: repeat 14801.9 7.21381 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14801.9 7.21381 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1908.87 7.21381 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 620 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 160.631 7.21381 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 183.483 7.21381 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -15.2483 11.2015 7.88393 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.2483 11.2015 7.88393 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 23.7599 11.2015 7.88393 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 691 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 13.8215 11.2015 7.88393 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 15.8039 11.2015 7.88393 0.154 protocols.relax.FastRelax: {0} CMD: min -14.6313 11.6945 8.88572 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.6313 11.6945 8.88572 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.65518 11.6945 8.88572 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 719 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -4.66115 11.6945 8.88572 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.87446 11.6945 8.88572 0.31955 protocols.relax.FastRelax: {0} CMD: min -12.8413 12.0659 9.65336 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.8413 12.0659 9.65336 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.34818 12.0659 9.65336 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -4.81916 12.0659 9.65336 0.55 protocols.relax.FastRelax: {0} CMD: min -14.3285 11.4804 9.67265 0.55 protocols.relax.FastRelax: {0} MRP: 0 -14.3285 -14.3285 11.4804 9.67265 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.3285 11.4804 9.67265 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.3285 11.4804 9.67265 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.3285 11.4804 9.67265 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.8693 11.4804 9.67265 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.7177 11.4804 9.67265 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.1121 11.4804 9.67265 0.02805 protocols.relax.FastRelax: {0} CMD: min -30.1396 11.4782 9.67081 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.1396 11.4782 9.67081 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.363 11.4782 9.67081 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.5089 11.4782 9.67081 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2484 11.4782 9.67081 0.154 protocols.relax.FastRelax: {0} CMD: min -26.2691 11.4758 9.66832 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.2691 11.4758 9.66832 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.4162 11.4758 9.66832 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.5444 11.4758 9.66832 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1751 11.4758 9.66832 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.1838 11.4746 9.66704 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.1838 11.4746 9.66704 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.1449 11.4746 9.66704 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.4036 11.4746 9.66704 0.55 protocols.relax.FastRelax: {0} CMD: min -15.5155 11.4107 9.59142 0.55 protocols.relax.FastRelax: {0} MRP: 1 -15.5155 -15.5155 11.4107 9.59142 protocols.relax.FastRelax: {0} CMD: accept_to_best -15.5155 11.4107 9.59142 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -15.5155 11.4107 9.59142 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.5155 11.4107 9.59142 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.7169 11.4107 9.59142 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.0593 11.4107 9.59142 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4489 11.4107 9.59142 0.02805 protocols.relax.FastRelax: {0} CMD: min -30.4721 11.4094 9.59036 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.4721 11.4094 9.59036 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.6123 11.4094 9.59036 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.8899 11.4094 9.59036 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.6293 11.4094 9.59036 0.154 protocols.relax.FastRelax: {0} CMD: min -26.6421 11.4074 9.5882 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.6421 11.4074 9.5882 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.7899 11.4074 9.5882 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 644 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.8781 11.4074 9.5882 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.509 11.4074 9.5882 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.5151 11.4061 9.58663 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.5151 11.4061 9.58663 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.4854 11.4061 9.58663 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.783 11.4061 9.58663 0.55 protocols.relax.FastRelax: {0} CMD: min -15.5176 11.3957 9.57856 0.55 protocols.relax.FastRelax: {0} MRP: 2 -15.5176 -15.5176 11.3957 9.57856 protocols.relax.FastRelax: {0} CMD: accept_to_best -15.5176 11.3957 9.57856 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -15.5176 11.3957 9.57856 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.5176 11.3957 9.57856 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.7337 11.3957 9.57856 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.0458 11.3957 9.57856 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4325 11.3957 9.57856 0.02805 protocols.relax.FastRelax: {0} CMD: min -30.4557 11.3944 9.57757 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.4557 11.3944 9.57757 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.5397 11.3944 9.57757 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.8856 11.3944 9.57757 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.6243 11.3944 9.57757 0.154 protocols.relax.FastRelax: {0} CMD: min -26.637 11.3924 9.57542 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.637 11.3924 9.57542 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.7722 11.3924 9.57542 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.8604 11.3924 9.57542 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.4903 11.3924 9.57542 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.4968 11.3911 9.57385 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.4968 11.3911 9.57385 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.4482 11.3911 9.57385 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.7599 11.3911 9.57385 0.55 protocols.relax.FastRelax: {0} CMD: min -15.5202 11.3893 9.5736 0.55 protocols.relax.FastRelax: {0} MRP: 3 -15.5202 -15.5202 11.3893 9.5736 protocols.relax.FastRelax: {0} CMD: accept_to_best -15.5202 11.3893 9.5736 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -15.5202 11.3893 9.5736 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.5202 11.3893 9.5736 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.7358 11.3893 9.5736 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.0535 11.3893 9.5736 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4401 11.3893 9.5736 0.02805 protocols.relax.FastRelax: {0} CMD: min -30.4634 11.388 9.57257 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.4634 11.388 9.57257 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.5481 11.388 9.57257 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.8881 11.388 9.57257 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.6269 11.388 9.57257 0.154 protocols.relax.FastRelax: {0} CMD: min -26.6397 11.3859 9.57039 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.6397 11.3859 9.57039 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.7771 11.3859 9.57039 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.8666 11.3859 9.57039 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.4967 11.3859 9.57039 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.5031 11.3846 9.56878 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.5031 11.3846 9.56878 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.4578 11.3846 9.56878 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.7697 11.3846 9.56878 0.55 protocols.relax.FastRelax: {0} CMD: min -15.5207 11.3864 9.5704 0.55 protocols.relax.FastRelax: {0} MRP: 4 -15.5207 -15.5207 11.3864 9.5704 protocols.relax.FastRelax: {0} CMD: accept_to_best -15.5207 11.3864 9.5704 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -15.5207 11.3864 9.5704 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_48.pdb protocols.relax.FastRelax: {0} CMD: repeat 12132.1 8.1634 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 12132.1 8.1634 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2138.62 8.1634 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 71.9363 8.1634 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 72.8534 8.1634 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 72.8116 8.16401 0.00589386 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 72.8116 8.16401 0.00589386 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 90.607 8.16401 0.00589386 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 88.1832 8.16401 0.00589386 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 89.2682 8.16401 0.00589386 0.154 protocols.relax.FastRelax: {0} CMD: min 60.9384 9.56911 3.36463 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 60.9384 9.56911 3.36463 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 83.011 9.56911 3.36463 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 62.6523 9.56911 3.36463 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 63.5288 9.56911 3.36463 0.31955 protocols.relax.FastRelax: {0} CMD: min 52.5118 9.58158 3.2812 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 52.5118 9.58158 3.2812 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 61.2606 9.58158 3.2812 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 61.1467 9.58158 3.2812 0.55 core.optimization.LineMinimizer: {0} [ ERROR ] Inaccurate G! step= 3.8147e-06 Deriv= -0.110979 Finite Diff= 0.0162948 protocols.relax.FastRelax: {0} CMD: min 2613.93 9.86164 5.61817 0.55 protocols.relax.FastRelax: {0} MRP: 0 2613.93 2613.93 9.86164 5.61817 protocols.relax.FastRelax: {0} CMD: accept_to_best 2613.93 9.86164 5.61817 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 2613.93 9.86164 5.61817 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 2613.93 9.86164 5.61817 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 101.316 9.86164 5.61817 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 42.8898 9.86164 5.61817 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 56.5951 9.86164 5.61817 0.02805 protocols.relax.FastRelax: {0} CMD: min 746.794 11.4258 8.37269 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 746.794 11.4258 8.37269 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 3962.95 11.4258 8.37269 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 584 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 2678.49 11.4258 8.37269 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2831.15 11.4258 8.37269 0.154 protocols.relax.FastRelax: {0} CMD: min 124.137 9.25089 3.77646 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 124.137 9.25089 3.77646 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 263.302 9.25089 3.77646 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 616 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 130.503 9.25089 3.77646 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 136.338 9.25089 3.77646 0.31955 protocols.relax.FastRelax: {0} CMD: min -4.05858 9.20205 3.89241 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -4.05858 9.20205 3.89241 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.51567 9.20205 3.89241 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 3.20653 9.20205 3.89241 0.55 protocols.relax.FastRelax: {0} CMD: min -4.81317 9.24556 5.11487 0.55 protocols.relax.FastRelax: {0} MRP: 1 -4.81317 -4.81317 9.24556 5.11487 protocols.relax.FastRelax: {0} CMD: accept_to_best -4.81317 9.24556 5.11487 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -4.81317 9.24556 5.11487 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -4.81317 9.24556 5.11487 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.1407 9.24556 5.11487 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 672 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.5173 9.24556 5.11487 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.3658 9.24556 5.11487 0.02805 protocols.relax.FastRelax: {0} CMD: min -19.8147 9.24481 5.11457 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.8147 9.24481 5.11457 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7988 9.24481 5.11457 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7989 9.24481 5.11457 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.5875 9.24481 5.11457 0.154 protocols.relax.FastRelax: {0} CMD: min -16.6147 9.24403 5.11311 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.6147 9.24403 5.11311 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.6765 9.24403 5.11311 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 650 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.6766 9.24403 5.11311 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.3661 9.24403 5.11311 0.31955 protocols.relax.FastRelax: {0} CMD: min -12.3912 9.24281 5.11241 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.3912 9.24281 5.11241 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.51511 9.24281 5.11241 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -6.51512 9.24281 5.11241 0.55 core.optimization.LineMinimizer: {0} [ ERROR ] Inaccurate G! step= 3.8147e-06 Deriv= -0.0075623 Finite Diff= 0.00545268 protocols.relax.FastRelax: {0} CMD: min -12.6345 9.80946 7.74094 0.55 protocols.relax.FastRelax: {0} MRP: 2 -12.6345 -12.6345 9.80946 7.74094 protocols.relax.FastRelax: {0} CMD: accept_to_best -12.6345 9.80946 7.74094 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -12.6345 9.80946 7.74094 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.6345 9.80946 7.74094 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5952 9.80946 7.74094 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 672 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9004 9.80946 7.74094 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7437 9.80946 7.74094 0.02805 protocols.relax.FastRelax: {0} CMD: min -36.0246 9.9637 8.72129 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.0246 9.9637 8.72129 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.6573 9.9637 8.72129 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 665 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.1269 9.9637 8.72129 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.1028 9.9637 8.72129 0.154 protocols.relax.FastRelax: {0} CMD: min -27.4231 9.98311 8.62986 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.4231 9.98311 8.62986 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.7449 9.98311 8.62986 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.7449 9.98311 8.62986 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.1395 9.98311 8.62986 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.5363 9.95864 8.61156 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.5363 9.95864 8.61156 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.15563 9.95864 8.61156 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 663 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.25762 9.95864 8.61156 0.55 core.optimization.LineMinimizer: {0} [ ERROR ] Inaccurate G! step= 3.8147e-06 Deriv= -0.0154134 Finite Diff= 0.0156168 protocols.relax.FastRelax: {0} CMD: min -16.0622 10.9577 11.5277 0.55 protocols.relax.FastRelax: {0} MRP: 3 -16.0622 -16.0622 10.9577 11.5277 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.0622 10.9577 11.5277 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.0622 10.9577 11.5277 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.0622 10.9577 11.5277 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.8116 10.9577 11.5277 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.1933 10.9577 11.5277 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.0097 10.9577 11.5277 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.6761 10.6304 11.0006 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.6761 10.6304 11.0006 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.2894 10.6304 11.0006 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 654 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.6069 10.6304 11.0006 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.4342 10.6304 11.0006 0.154 protocols.relax.FastRelax: {0} CMD: min -32.5792 10.6895 11.1123 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.5792 10.6895 11.1123 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0841 10.6895 11.1123 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 653 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.0841 10.6895 11.1123 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.4142 10.6895 11.1123 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.105 10.685 11.1572 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.105 10.685 11.1572 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.915 10.685 11.1572 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 650 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.9898 10.685 11.1572 0.55 protocols.relax.FastRelax: {0} CMD: min -19.838 10.6053 10.9948 0.55 protocols.relax.FastRelax: {0} MRP: 4 -19.838 -19.838 10.6053 10.9948 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.838 10.6053 10.9948 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.838 10.6053 10.9948 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_4.pdb protocols.relax.FastRelax: {0} CMD: repeat 15133.4 7.74311 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15133.4 7.74311 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2208.64 7.74311 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 615 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 100.47 7.74311 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 118.857 7.74311 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 100.292 8.42868 6.05007 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 100.292 8.42868 6.05007 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 723.766 8.42868 6.05007 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.1693 8.42868 6.05007 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.6006 8.42868 6.05007 0.154 protocols.relax.FastRelax: {0} CMD: min -34.5057 8.58481 6.35058 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.5057 8.58481 6.35058 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.7914 8.58481 6.35058 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 639 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.97 8.58481 6.35058 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.2228 8.58481 6.35058 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.6478 8.57378 6.35131 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.6478 8.57378 6.35131 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.0898 8.57378 6.35131 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.1002 8.57378 6.35131 0.55 protocols.relax.FastRelax: {0} CMD: min -23.5485 8.8282 7.09862 0.55 protocols.relax.FastRelax: {0} MRP: 0 -23.5485 -23.5485 8.8282 7.09862 protocols.relax.FastRelax: {0} CMD: accept_to_best -23.5485 8.8282 7.09862 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -23.5485 8.8282 7.09862 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.5485 8.8282 7.09862 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.7159 8.8282 7.09862 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.655 8.8282 7.09862 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.4612 8.8282 7.09862 0.02805 protocols.relax.FastRelax: {0} CMD: min -49.4387 8.96569 6.95549 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -49.4387 8.96569 6.95549 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.8557 8.96569 6.95549 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 822 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.9888 8.96569 6.95549 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.6608 8.96569 6.95549 0.154 protocols.relax.FastRelax: {0} CMD: min -37.5057 8.90787 7.06814 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.5057 8.90787 7.06814 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.5338 8.90787 7.06814 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.9417 8.90787 7.06814 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2431 8.90787 7.06814 0.31955 protocols.relax.FastRelax: {0} CMD: min -30.0036 8.89434 7.0422 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.0036 8.89434 7.0422 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.0214 8.89434 7.0422 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.0242 8.89434 7.0422 0.55 protocols.relax.FastRelax: {0} CMD: min -27.8976 9.34858 7.34431 0.55 protocols.relax.FastRelax: {0} MRP: 1 -27.8976 -27.8976 9.34858 7.34431 protocols.relax.FastRelax: {0} CMD: accept_to_best -27.8976 9.34858 7.34431 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -27.8976 9.34858 7.34431 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.8976 9.34858 7.34431 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.6428 9.34858 7.34431 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.2185 9.34858 7.34431 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.0187 9.34858 7.34431 0.02805 protocols.relax.FastRelax: {0} CMD: min -48.6046 9.35479 7.26816 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -48.6046 9.35479 7.26816 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.4662 9.35479 7.26816 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 717 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.453 9.35479 7.26816 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5339 9.35479 7.26816 0.154 protocols.relax.FastRelax: {0} CMD: min -42.625 9.34748 7.23961 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.625 9.34748 7.23961 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.547 9.34748 7.23961 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.5546 9.34748 7.23961 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9178 9.34748 7.23961 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.9055 9.34659 7.22921 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.9055 9.34659 7.22921 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3962 9.34659 7.22921 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.3987 9.34659 7.22921 0.55 protocols.relax.FastRelax: {0} CMD: min -33.4894 9.56987 7.47853 0.55 protocols.relax.FastRelax: {0} MRP: 2 -33.4894 -33.4894 9.56987 7.47853 protocols.relax.FastRelax: {0} CMD: accept_to_best -33.4894 9.56987 7.47853 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -33.4894 9.56987 7.47853 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4894 9.56987 7.47853 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.8192 9.56987 7.47853 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 728 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.248 9.56987 7.47853 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.0385 9.56987 7.47853 0.02805 protocols.relax.FastRelax: {0} CMD: min -52.7655 9.56459 7.44259 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.7655 9.56459 7.44259 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.2652 9.56459 7.44259 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.6892 9.56459 7.44259 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.8552 9.56459 7.44259 0.154 protocols.relax.FastRelax: {0} CMD: min -46.101 9.59316 7.5309 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.101 9.59316 7.5309 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.625 9.59316 7.5309 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 644 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.9276 9.59316 7.5309 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.3382 9.59316 7.5309 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.1673 9.62311 7.51892 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.1673 9.62311 7.51892 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.6601 9.62311 7.51892 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.6634 9.62311 7.51892 0.55 protocols.relax.FastRelax: {0} CMD: min -33.4896 9.57271 7.48572 0.55 protocols.relax.FastRelax: {0} MRP: 3 -33.4896 -33.4896 9.57271 7.48572 protocols.relax.FastRelax: {0} CMD: accept_to_best -33.4896 9.57271 7.48572 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -33.4896 9.57271 7.48572 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4896 9.57271 7.48572 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.8586 9.57271 7.48572 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 728 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.2878 9.57271 7.48572 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.0769 9.57271 7.48572 0.02805 protocols.relax.FastRelax: {0} CMD: min -52.7821 9.56723 7.44996 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.7821 9.56723 7.44996 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.1768 9.56723 7.44996 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.609 9.56723 7.44996 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.7685 9.56723 7.44996 0.154 protocols.relax.FastRelax: {0} CMD: min -46.1827 9.59635 7.53458 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.1827 9.59635 7.53458 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.6647 9.59635 7.53458 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.9251 9.59635 7.53458 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.3317 9.59635 7.53458 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.1532 9.62964 7.52111 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.1532 9.62964 7.52111 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.7108 9.62964 7.52111 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.7109 9.62964 7.52111 0.55 protocols.relax.FastRelax: {0} CMD: min -33.4891 9.5735 7.48753 0.55 protocols.relax.FastRelax: {0} MRP: 4 -33.4891 -33.4896 9.57271 7.48572 protocols.relax.FastRelax: {0} CMD: accept_to_best -33.4891 9.5735 7.48753 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -33.4891 9.5735 7.48753 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_24.pdb protocols.relax.FastRelax: {0} CMD: repeat 12022.6 5.96034 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 12022.6 5.96034 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1769.25 5.96034 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 804 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 60.3224 5.96034 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 66.1538 5.96034 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -36.7941 7.01929 2.70254 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.7941 7.01929 2.70254 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.6729 7.01929 2.70254 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 933 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.4768 7.01929 2.70254 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.8549 7.01929 2.70254 0.154 protocols.relax.FastRelax: {0} CMD: min -24.1464 7.16511 2.72841 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.1464 7.16511 2.72841 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.60789 7.16511 2.72841 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 878 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.7139 7.16511 2.72841 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.53166 7.16511 2.72841 0.31955 protocols.relax.FastRelax: {0} CMD: min -27.7186 7.51784 3.21492 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.7186 7.51784 3.21492 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.9766 7.51784 3.21492 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1027 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.2248 7.51784 3.21492 0.55 protocols.relax.FastRelax: {0} CMD: min -28.6359 7.79456 3.92096 0.55 protocols.relax.FastRelax: {0} MRP: 0 -28.6359 -28.6359 7.79456 3.92096 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.6359 7.79456 3.92096 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.6359 7.79456 3.92096 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.6359 7.79456 3.92096 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -45.9102 7.79456 3.92096 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1202 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.8247 7.79456 3.92096 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.5067 7.79456 3.92096 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.5477 7.75868 3.89806 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.5477 7.75868 3.89806 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1932 7.75868 3.89806 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1160 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.765 7.75868 3.89806 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.7694 7.75868 3.89806 0.154 protocols.relax.FastRelax: {0} CMD: min -43.6232 7.73599 3.89222 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.6232 7.73599 3.89222 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.31 7.73599 3.89222 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1156 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.3107 7.73599 3.89222 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.5764 7.73599 3.89222 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.4275 7.7613 3.90617 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.4275 7.7613 3.90617 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.3383 7.7613 3.90617 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1063 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.56 7.7613 3.90617 0.55 protocols.relax.FastRelax: {0} CMD: min -34.8859 7.75647 4.16155 0.55 protocols.relax.FastRelax: {0} MRP: 1 -34.8859 -34.8859 7.75647 4.16155 protocols.relax.FastRelax: {0} CMD: accept_to_best -34.8859 7.75647 4.16155 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -34.8859 7.75647 4.16155 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.8859 7.75647 4.16155 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.8816 7.75647 4.16155 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1080 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -54.4738 7.75647 4.16155 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -54.0928 7.75647 4.16155 0.02805 protocols.relax.FastRelax: {0} CMD: min -59.5942 7.84079 4.24232 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -59.5942 7.84079 4.24232 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -45.8241 7.84079 4.24232 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1037 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.4632 7.84079 4.24232 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.689 7.84079 4.24232 0.154 protocols.relax.FastRelax: {0} CMD: min -50.0211 7.82134 4.21807 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.0211 7.82134 4.21807 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.3584 7.82134 4.21807 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1081 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.7513 7.82134 4.21807 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.9365 7.82134 4.21807 0.31955 protocols.relax.FastRelax: {0} CMD: min -39.7358 7.8085 4.20504 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.7358 7.8085 4.20504 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.3417 7.8085 4.20504 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1054 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.331 7.8085 4.20504 0.55 protocols.relax.FastRelax: {0} CMD: min -35.2138 7.78594 4.18866 0.55 protocols.relax.FastRelax: {0} MRP: 2 -35.2138 -35.2138 7.78594 4.18866 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.2138 7.78594 4.18866 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.2138 7.78594 4.18866 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.2138 7.78594 4.18866 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -53.0866 7.78594 4.18866 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1079 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -54.6152 7.78594 4.18866 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -54.2356 7.78594 4.18866 0.02805 protocols.relax.FastRelax: {0} CMD: min -57.7185 7.87738 4.26911 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -57.7185 7.87738 4.26911 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.2925 7.87738 4.26911 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1024 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.3226 7.87738 4.26911 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.0562 7.87738 4.26911 0.154 protocols.relax.FastRelax: {0} CMD: min -50.1693 7.83575 4.23755 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.1693 7.83575 4.23755 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.758 7.83575 4.23755 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1073 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.9054 7.83575 4.23755 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1001 7.83575 4.23755 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.2011 7.82486 4.22316 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.2011 7.82486 4.22316 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.5946 7.82486 4.22316 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1034 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.5956 7.82486 4.22316 0.55 protocols.relax.FastRelax: {0} CMD: min -35.2342 7.78174 4.18586 0.55 protocols.relax.FastRelax: {0} MRP: 3 -35.2342 -35.2342 7.78174 4.18586 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.2342 7.78174 4.18586 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.2342 7.78174 4.18586 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.2342 7.78174 4.18586 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -53.1332 7.78174 4.18586 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1085 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -54.651 7.78174 4.18586 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -54.2727 7.78174 4.18586 0.02805 protocols.relax.FastRelax: {0} CMD: min -57.5968 7.88318 4.27081 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -57.5968 7.88318 4.27081 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.6608 7.88318 4.27081 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1024 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.8713 7.88318 4.27081 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.5754 7.88318 4.27081 0.154 protocols.relax.FastRelax: {0} CMD: min -49.8918 7.80159 4.23102 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -49.8918 7.80159 4.23102 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.9263 7.80159 4.23102 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1079 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.0285 7.80159 4.23102 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.2432 7.80159 4.23102 0.31955 protocols.relax.FastRelax: {0} CMD: min -41.1667 7.80941 4.21308 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.1667 7.80941 4.21308 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.2979 7.80941 4.21308 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1012 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.2987 7.80941 4.21308 0.55 protocols.relax.FastRelax: {0} CMD: min -35.2546 7.78882 4.19152 0.55 protocols.relax.FastRelax: {0} MRP: 4 -35.2546 -35.2546 7.78882 4.19152 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.2546 7.78882 4.19152 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.2546 7.78882 4.19152 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_47.pdb protocols.relax.FastRelax: {0} CMD: repeat 15597.2 9.36402 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15597.2 9.36402 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1942.27 9.36402 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 756 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 96.6008 9.36402 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 105.813 9.36402 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -17.6396 9.6364 2.29668 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6396 9.6364 2.29668 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 11.3543 9.6364 2.29668 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 9.49926 9.6364 2.29668 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 11.4446 9.6364 2.29668 0.154 protocols.relax.FastRelax: {0} CMD: min -15.7006 9.54383 2.15441 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.7006 9.54383 2.15441 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.93745 9.54383 2.15441 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 681 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.05866 9.54383 2.15441 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.21488 9.54383 2.15441 0.31955 protocols.relax.FastRelax: {0} CMD: min -6.97569 9.53309 2.15457 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -6.97569 9.53309 2.15457 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.01123 9.53309 2.15457 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 4.00762 9.53309 2.15457 0.55 protocols.relax.FastRelax: {0} CMD: min -2.48786 9.5393 2.72965 0.55 protocols.relax.FastRelax: {0} MRP: 0 -2.48786 -2.48786 9.5393 2.72965 protocols.relax.FastRelax: {0} CMD: accept_to_best -2.48786 9.5393 2.72965 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -2.48786 9.5393 2.72965 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -2.48786 9.5393 2.72965 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5386 9.5393 2.72965 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 717 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.7574 9.5393 2.72965 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5441 9.5393 2.72965 0.02805 protocols.relax.FastRelax: {0} CMD: min -32.2278 9.52478 2.88109 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.2278 9.52478 2.88109 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 5.01208 9.52478 2.88109 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 798 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 0.870271 9.52478 2.88109 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.8012 9.52478 2.88109 0.154 protocols.relax.FastRelax: {0} CMD: min -24.0095 9.47728 3.08533 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.0095 9.47728 3.08533 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.5394 9.47728 3.08533 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 815 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.5431 9.47728 3.08533 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.7201 9.47728 3.08533 0.31955 protocols.relax.FastRelax: {0} CMD: min -15.0361 9.46572 3.07126 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.0361 9.46572 3.07126 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.88157 9.46572 3.07126 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 808 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -4.09709 9.46572 3.07126 0.55 protocols.relax.FastRelax: {0} CMD: min -11.029 9.57986 3.17691 0.55 protocols.relax.FastRelax: {0} MRP: 1 -11.029 -11.029 9.57986 3.17691 protocols.relax.FastRelax: {0} CMD: accept_to_best -11.029 9.57986 3.17691 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -11.029 9.57986 3.17691 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.029 9.57986 3.17691 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.4104 9.57986 3.17691 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 843 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.4995 9.57986 3.17691 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.2395 9.57986 3.17691 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.5541 9.61494 3.28072 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.5541 9.61494 3.28072 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.2788 9.61494 3.28072 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 827 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.1193 9.61494 3.28072 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7603 9.61494 3.28072 0.154 protocols.relax.FastRelax: {0} CMD: min -27.3217 9.55748 3.2007 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.3217 9.55748 3.2007 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.7094 9.55748 3.2007 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 820 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.7129 9.55748 3.2007 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.9548 9.55748 3.2007 0.31955 protocols.relax.FastRelax: {0} CMD: min -18.6674 9.54524 3.15167 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.6674 9.54524 3.15167 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.31643 9.54524 3.15167 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 808 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.32742 9.54524 3.15167 0.55 protocols.relax.FastRelax: {0} CMD: min -11.8163 9.59968 3.19211 0.55 protocols.relax.FastRelax: {0} MRP: 2 -11.8163 -11.8163 9.59968 3.19211 protocols.relax.FastRelax: {0} CMD: accept_to_best -11.8163 9.59968 3.19211 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -11.8163 9.59968 3.19211 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.8163 9.59968 3.19211 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.0198 9.59968 3.19211 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 841 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.723 9.59968 3.19211 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4668 9.59968 3.19211 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.1128 9.60784 3.20511 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.1128 9.60784 3.20511 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.6883 9.60784 3.20511 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 821 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.885 9.60784 3.20511 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.9639 9.60784 3.20511 0.154 protocols.relax.FastRelax: {0} CMD: min -27.0237 9.59944 3.23239 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.0237 9.59944 3.23239 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.6252 9.59944 3.23239 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 821 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.6252 9.59944 3.23239 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.963 9.59944 3.23239 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.1377 9.58157 3.2008 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.1377 9.58157 3.2008 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.30991 9.58157 3.2008 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 808 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.311 9.58157 3.2008 0.55 protocols.relax.FastRelax: {0} CMD: min -11.8176 9.59879 3.18885 0.55 protocols.relax.FastRelax: {0} MRP: 3 -11.8176 -11.8176 9.59879 3.18885 protocols.relax.FastRelax: {0} CMD: accept_to_best -11.8176 9.59879 3.18885 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -11.8176 9.59879 3.18885 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.8176 9.59879 3.18885 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.007 9.59879 3.18885 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 840 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.6969 9.59879 3.18885 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4417 9.59879 3.18885 0.02805 protocols.relax.FastRelax: {0} CMD: min -38.8311 9.63205 3.26785 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.8311 9.63205 3.26785 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.427 9.63205 3.26785 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 826 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.8383 9.63205 3.26785 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.5672 9.63205 3.26785 0.154 protocols.relax.FastRelax: {0} CMD: min -27.7549 9.59495 3.21357 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.7549 9.59495 3.21357 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.1037 9.59495 3.21357 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 811 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.1648 9.59495 3.21357 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.4132 9.59495 3.21357 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.845 9.59175 3.20628 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.845 9.59175 3.20628 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.44642 9.59175 3.20628 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 806 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.44703 9.59175 3.20628 0.55 protocols.relax.FastRelax: {0} CMD: min -12.5396 9.59666 3.2009 0.55 protocols.relax.FastRelax: {0} MRP: 4 -12.5396 -12.5396 9.59666 3.2009 protocols.relax.FastRelax: {0} CMD: accept_to_best -12.5396 9.59666 3.2009 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -12.5396 9.59666 3.2009 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_30.pdb protocols.relax.FastRelax: {0} CMD: repeat 16010.1 8.48056 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16010.1 8.48056 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2238.9 8.48056 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 620 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 70.6847 8.48056 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 72.7797 8.48056 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 72.7004 8.48314 0.00386485 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 72.7004 8.48314 0.00386485 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 113.198 8.48314 0.00386485 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 108.887 8.48314 0.00386485 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 111.295 8.48314 0.00386485 0.154 protocols.relax.FastRelax: {0} CMD: min -3.31302 11.3208 8.21862 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -3.31302 11.3208 8.21862 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 0.667492 11.3208 8.21862 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 701 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -4.83217 11.3208 8.21862 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.46302 11.3208 8.21862 0.31955 protocols.relax.FastRelax: {0} CMD: min -4.48554 11.3191 8.21938 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -4.48554 11.3191 8.21938 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.53147 11.3191 8.21938 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 695 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 2.08287 11.3191 8.21938 0.55 protocols.relax.FastRelax: {0} CMD: min -14.7696 10.6398 11.4761 0.55 protocols.relax.FastRelax: {0} MRP: 0 -14.7696 -14.7696 10.6398 11.4761 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.7696 10.6398 11.4761 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.7696 10.6398 11.4761 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.7696 10.6398 11.4761 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0994 10.6398 11.4761 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 719 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.222 10.6398 11.4761 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.0335 10.6398 11.4761 0.02805 protocols.relax.FastRelax: {0} CMD: min -26.0407 10.6393 11.4765 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.0407 10.6393 11.4765 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.3726 10.6393 11.4765 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.0253 10.6393 11.4765 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.8407 10.6393 11.4765 0.154 protocols.relax.FastRelax: {0} CMD: min -22.845 10.6387 11.4769 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.845 10.6387 11.4769 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.4111 10.6387 11.4769 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 690 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.4513 10.6387 11.4769 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.1849 10.6387 11.4769 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.193 10.6378 11.4772 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.193 10.6378 11.4772 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.1246 10.6378 11.4772 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 688 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.358 10.6378 11.4772 0.55 protocols.relax.FastRelax: {0} CMD: min -16.4495 10.5417 11.4698 0.55 protocols.relax.FastRelax: {0} MRP: 1 -16.4495 -16.4495 10.5417 11.4698 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.4495 10.5417 11.4698 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.4495 10.5417 11.4698 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.4495 10.5417 11.4698 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2514 10.5417 11.4698 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 718 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.165 10.5417 11.4698 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.9851 10.5417 11.4698 0.02805 protocols.relax.FastRelax: {0} CMD: min -26.9934 10.541 11.4702 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.9934 10.541 11.4702 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.4921 10.541 11.4702 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.1467 10.541 11.4702 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.9739 10.541 11.4702 0.154 protocols.relax.FastRelax: {0} CMD: min -23.9779 10.5404 11.4706 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.9779 10.5404 11.4706 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7631 10.5404 11.4706 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 689 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.7631 10.5404 11.4706 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5096 10.5404 11.4706 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.5135 10.5398 11.4708 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.5135 10.5398 11.4708 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.6876 10.5398 11.4708 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 687 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.9508 10.5398 11.4708 0.55 protocols.relax.FastRelax: {0} CMD: min -16.452 10.5456 11.4501 0.55 protocols.relax.FastRelax: {0} MRP: 2 -16.452 -16.452 10.5456 11.4501 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.452 10.5456 11.4501 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.452 10.5456 11.4501 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.452 10.5456 11.4501 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2346 10.5456 11.4501 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 718 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1665 10.5456 11.4501 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.9865 10.5456 11.4501 0.02805 protocols.relax.FastRelax: {0} CMD: min -26.9948 10.545 11.4506 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.9948 10.545 11.4506 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.4915 10.545 11.4506 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.1453 10.545 11.4506 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.9724 10.545 11.4506 0.154 protocols.relax.FastRelax: {0} CMD: min -23.9763 10.5443 11.4509 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.9763 10.5443 11.4509 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7573 10.5443 11.4509 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 689 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.7573 10.5443 11.4509 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5035 10.5443 11.4509 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.5076 10.5437 11.4511 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.5076 10.5437 11.4511 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.6758 10.5437 11.4511 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 686 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.9493 10.5437 11.4511 0.55 protocols.relax.FastRelax: {0} CMD: min -16.4528 10.5368 11.4353 0.55 protocols.relax.FastRelax: {0} MRP: 3 -16.4528 -16.4528 10.5368 11.4353 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.4528 10.5368 11.4353 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.4528 10.5368 11.4353 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.4528 10.5368 11.4353 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2354 10.5368 11.4353 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 718 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1674 10.5368 11.4353 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.9877 10.5368 11.4353 0.02805 protocols.relax.FastRelax: {0} CMD: min -26.9959 10.5362 11.4358 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.9959 10.5362 11.4358 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.4968 10.5362 11.4358 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.1506 10.5362 11.4358 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.9779 10.5362 11.4358 0.154 protocols.relax.FastRelax: {0} CMD: min -23.9818 10.5355 11.4362 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.9818 10.5355 11.4362 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7682 10.5355 11.4362 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 689 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.7682 10.5355 11.4362 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5148 10.5355 11.4362 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.5187 10.535 11.4364 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.5187 10.535 11.4364 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.6947 10.535 11.4364 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 687 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.9472 10.535 11.4364 0.55 protocols.relax.FastRelax: {0} CMD: min -16.4587 10.5183 11.4334 0.55 protocols.relax.FastRelax: {0} MRP: 4 -16.4587 -16.4587 10.5183 11.4334 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.4587 10.5183 11.4334 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.4587 10.5183 11.4334 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_25.pdb protocols.relax.FastRelax: {0} CMD: repeat 16632.1 7.40067 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16632.1 7.40067 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1913.52 7.40067 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 612 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 51.8134 7.40067 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 59.5097 7.40067 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.0857 7.3676 4.23177 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.0857 7.3676 4.23177 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.8966 7.3676 4.23177 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 663 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.9477 7.3676 4.23177 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.5967 7.3676 4.23177 0.154 protocols.relax.FastRelax: {0} CMD: min -38.3092 7.65233 5.17837 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.3092 7.65233 5.17837 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.2896 7.65233 5.17837 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.1291 7.65233 5.17837 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4827 7.65233 5.17837 0.31955 protocols.relax.FastRelax: {0} CMD: min -36.7743 7.77021 5.24881 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.7743 7.77021 5.24881 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.9528 7.77021 5.24881 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.134 7.77021 5.24881 0.55 protocols.relax.FastRelax: {0} CMD: min -33.5701 8.30674 7.13038 0.55 protocols.relax.FastRelax: {0} MRP: 0 -33.5701 -33.5701 8.30674 7.13038 protocols.relax.FastRelax: {0} CMD: accept_to_best -33.5701 8.30674 7.13038 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -33.5701 8.30674 7.13038 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.5701 8.30674 7.13038 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.8306 8.30674 7.13038 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 653 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -53.302 8.30674 7.13038 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.3895 8.30674 7.13038 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.9702 8.25457 6.93502 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.9702 8.25457 6.93502 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.0199 8.25457 6.93502 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.5776 8.25457 6.93502 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.2739 8.25457 6.93502 0.154 protocols.relax.FastRelax: {0} CMD: min -49.9802 8.15658 7.05483 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -49.9802 8.15658 7.05483 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.6168 8.15658 7.05483 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.6565 8.15658 7.05483 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.0005 8.15658 7.05483 0.31955 protocols.relax.FastRelax: {0} CMD: min -41.606 8.16535 7.08273 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.606 8.16535 7.08273 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.0996 8.16535 7.08273 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 620 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.6181 8.16535 7.08273 0.55 protocols.relax.FastRelax: {0} CMD: min -35.768 8.59261 7.6013 0.55 protocols.relax.FastRelax: {0} MRP: 1 -35.768 -35.768 8.59261 7.6013 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.768 8.59261 7.6013 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.768 8.59261 7.6013 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.768 8.59261 7.6013 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.0829 8.59261 7.6013 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -54.1416 8.59261 7.6013 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -53.2323 8.59261 7.6013 0.02805 protocols.relax.FastRelax: {0} CMD: min -55.6582 8.53627 7.40201 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -55.6582 8.53627 7.40201 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.1675 8.53627 7.40201 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.7359 8.53627 7.40201 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.3936 8.53627 7.40201 0.154 protocols.relax.FastRelax: {0} CMD: min -50.1288 8.40615 7.54565 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.1288 8.40615 7.54565 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.5878 8.40615 7.54565 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.6412 8.40615 7.54565 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.9728 8.40615 7.54565 0.31955 protocols.relax.FastRelax: {0} CMD: min -43.0885 8.52719 7.52236 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.0885 8.52719 7.52236 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.834 8.52719 7.52236 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 615 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.0713 8.52719 7.52236 0.55 protocols.relax.FastRelax: {0} CMD: min -35.7673 8.61602 7.63263 0.55 protocols.relax.FastRelax: {0} MRP: 2 -35.7673 -35.768 8.59261 7.6013 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.7673 8.61602 7.63263 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.7673 8.61602 7.63263 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.7673 8.61602 7.63263 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.105 8.61602 7.63263 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -54.1595 8.61602 7.63263 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -53.2491 8.61602 7.63263 0.02805 protocols.relax.FastRelax: {0} CMD: min -55.732 8.55699 7.43352 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -55.732 8.55699 7.43352 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.7339 8.55699 7.43352 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.3803 8.55699 7.43352 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.0758 8.55699 7.43352 0.154 protocols.relax.FastRelax: {0} CMD: min -50.0313 8.43753 7.60112 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.0313 8.43753 7.60112 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.0019 8.43753 7.60112 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.0344 8.43753 7.60112 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.4053 8.43753 7.60112 0.31955 protocols.relax.FastRelax: {0} CMD: min -42.6833 8.47758 7.57023 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.6833 8.47758 7.57023 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.4245 8.47758 7.57023 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 619 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.0468 8.47758 7.57023 0.55 protocols.relax.FastRelax: {0} CMD: min -35.7785 8.59902 7.61281 0.55 protocols.relax.FastRelax: {0} MRP: 3 -35.7785 -35.7785 8.59902 7.61281 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.7785 8.59902 7.61281 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.7785 8.59902 7.61281 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.7785 8.59902 7.61281 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.095 8.59902 7.61281 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -54.0885 8.59902 7.61281 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -53.178 8.59902 7.61281 0.02805 protocols.relax.FastRelax: {0} CMD: min -55.6572 8.54192 7.41357 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -55.6572 8.54192 7.41357 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.4016 8.54192 7.41357 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.9808 8.54192 7.41357 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.6558 8.54192 7.41357 0.154 protocols.relax.FastRelax: {0} CMD: min -50.421 8.43192 7.52488 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.421 8.43192 7.52488 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.602 8.43192 7.52488 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.6482 8.43192 7.52488 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.0359 8.43192 7.52488 0.31955 protocols.relax.FastRelax: {0} CMD: min -42.2981 8.43497 7.53552 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.2981 8.43497 7.53552 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.1206 8.43497 7.53552 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 623 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.739 8.43497 7.53552 0.55 protocols.relax.FastRelax: {0} CMD: min -35.7656 8.61125 7.62711 0.55 protocols.relax.FastRelax: {0} MRP: 4 -35.7656 -35.7785 8.59902 7.61281 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.7656 8.61125 7.62711 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.7656 8.61125 7.62711 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_19.pdb protocols.relax.FastRelax: {0} CMD: repeat 15759.3 9.18135 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15759.3 9.18135 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2156.23 9.18135 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 753 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 68.175 9.18135 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 82.2555 9.18135 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.2437 9.24806 1.32816 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.2437 9.24806 1.32816 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.3497 9.24806 1.32816 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 718 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.3465 9.24806 1.32816 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.8515 9.24806 1.32816 0.154 protocols.relax.FastRelax: {0} CMD: min -35.1563 9.31684 1.26477 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.1563 9.31684 1.26477 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.7981 9.31684 1.26477 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 767 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.0416 9.31684 1.26477 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.4099 9.31684 1.26477 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.6009 9.30983 1.26658 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.6009 9.30983 1.26658 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.0822 9.30983 1.26658 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 761 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.0833 9.30983 1.26658 0.55 protocols.relax.FastRelax: {0} CMD: min -27.7322 9.36016 1.20211 0.55 protocols.relax.FastRelax: {0} MRP: 0 -27.7322 -27.7322 9.36016 1.20211 protocols.relax.FastRelax: {0} CMD: accept_to_best -27.7322 9.36016 1.20211 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -27.7322 9.36016 1.20211 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.7322 9.36016 1.20211 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.6027 9.36016 1.20211 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 739 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.4821 9.36016 1.20211 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.2943 9.36016 1.20211 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.894 9.38118 1.19949 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.894 9.38118 1.19949 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.8605 9.38118 1.19949 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 709 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.8607 9.38118 1.19949 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.578 9.38118 1.19949 0.154 protocols.relax.FastRelax: {0} CMD: min -38.6986 9.36982 1.19849 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.6986 9.36982 1.19849 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.6557 9.36982 1.19849 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 701 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.6562 9.36982 1.19849 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.2586 9.36982 1.19849 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.2986 9.3622 1.20057 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.2986 9.3622 1.20057 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9442 9.3622 1.20057 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 687 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.6748 9.3622 1.20057 0.55 protocols.relax.FastRelax: {0} CMD: min -27.9563 9.40057 1.2548 0.55 protocols.relax.FastRelax: {0} MRP: 1 -27.9563 -27.9563 9.40057 1.2548 protocols.relax.FastRelax: {0} CMD: accept_to_best -27.9563 9.40057 1.2548 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -27.9563 9.40057 1.2548 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.9563 9.40057 1.2548 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.9095 9.40057 1.2548 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 729 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.8496 9.40057 1.2548 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.6588 9.40057 1.2548 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.2594 9.4213 1.25626 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.2594 9.4213 1.25626 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.171 9.4213 1.25626 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 697 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.1712 9.4213 1.25626 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.8847 9.4213 1.25626 0.154 protocols.relax.FastRelax: {0} CMD: min -38.9641 9.41223 1.2564 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.9641 9.41223 1.2564 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.852 9.41223 1.2564 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 691 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.8523 9.41223 1.2564 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4493 9.41223 1.2564 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.5016 9.40434 1.25626 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.5016 9.40434 1.25626 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.043 9.40434 1.25626 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 684 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.7722 9.40434 1.25626 0.55 protocols.relax.FastRelax: {0} CMD: min -28.0563 9.40527 1.27349 0.55 protocols.relax.FastRelax: {0} MRP: 2 -28.0563 -28.0563 9.40527 1.27349 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.0563 9.40527 1.27349 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.0563 9.40527 1.27349 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.0563 9.40527 1.27349 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.9648 9.40527 1.27349 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 762 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.8461 9.40527 1.27349 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.6567 9.40527 1.27349 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.2542 9.42634 1.27608 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.2542 9.42634 1.27608 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1884 9.42634 1.27608 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 731 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.1886 9.42634 1.27608 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.9036 9.42634 1.27608 0.154 protocols.relax.FastRelax: {0} CMD: min -39.0245 9.41478 1.27036 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.0245 9.41478 1.27036 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9391 9.41478 1.27036 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 725 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.9396 9.41478 1.27036 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.5387 9.41478 1.27036 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.5807 9.4071 1.27216 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.5807 9.4071 1.27216 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.1678 9.4071 1.27216 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 718 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.8894 9.4071 1.27216 0.55 protocols.relax.FastRelax: {0} CMD: min -28.0573 9.40672 1.27909 0.55 protocols.relax.FastRelax: {0} MRP: 3 -28.0573 -28.0573 9.40672 1.27909 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.0573 9.40672 1.27909 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.0573 9.40672 1.27909 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.0573 9.40672 1.27909 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.9549 9.40672 1.27909 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 761 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.8537 9.40672 1.27909 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.6647 9.40672 1.27909 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.2583 9.42775 1.28183 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.2583 9.42775 1.28183 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.2011 9.42775 1.28183 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 731 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.2013 9.42775 1.28183 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.9169 9.42775 1.28183 0.154 protocols.relax.FastRelax: {0} CMD: min -39.0384 9.41617 1.27605 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.0384 9.41617 1.27605 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9626 9.41617 1.27605 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 725 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.9631 9.41617 1.27605 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.5629 9.41617 1.27605 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.6046 9.40844 1.27787 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.6046 9.40844 1.27787 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2062 9.40844 1.27787 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 717 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.9098 9.40844 1.27787 0.55 protocols.relax.FastRelax: {0} CMD: min -28.0569 9.40844 1.28283 0.55 protocols.relax.FastRelax: {0} MRP: 4 -28.0569 -28.0573 9.40672 1.27909 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.0569 9.40844 1.28283 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.0569 9.40844 1.28283 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_40.pdb protocols.relax.FastRelax: {0} CMD: repeat 14894.4 6.95135 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14894.4 6.95135 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1939.82 6.95135 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 562 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 60.2545 6.95135 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 63.5423 6.95135 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 63.3367 6.95733 0.0175058 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 63.3367 6.95733 0.0175058 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 126.265 6.95733 0.0175058 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 545 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 121.404 6.95733 0.0175058 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 125.314 6.95733 0.0175058 0.154 protocols.relax.FastRelax: {0} CMD: min -27.741 7.93917 4.18652 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.741 7.93917 4.18652 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7335 7.93917 4.18652 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 605 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.7222 7.93917 4.18652 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.177 7.93917 4.18652 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.2385 7.93999 4.18461 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2385 7.93999 4.18461 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.967 7.93999 4.18461 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 600 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.991 7.93999 4.18461 0.55 protocols.relax.FastRelax: {0} CMD: min -22.4261 8.57247 4.45828 0.55 protocols.relax.FastRelax: {0} MRP: 0 -22.4261 -22.4261 8.57247 4.45828 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.4261 8.57247 4.45828 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.4261 8.57247 4.45828 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.4261 8.57247 4.45828 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.7403 8.57247 4.45828 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.4434 8.57247 4.45828 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.2675 8.57247 4.45828 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.9858 8.52359 4.68814 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.9858 8.52359 4.68814 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.0582 8.52359 4.68814 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.6104 8.52359 4.68814 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.6537 8.52359 4.68814 0.154 protocols.relax.FastRelax: {0} CMD: min -36.0565 8.60805 4.75451 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.0565 8.60805 4.75451 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2482 8.60805 4.75451 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 600 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.27 8.60805 4.75451 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.6547 8.60805 4.75451 0.31955 protocols.relax.FastRelax: {0} CMD: min -28.0367 8.6077 4.76291 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.0367 8.6077 4.76291 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.8972 8.6077 4.76291 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 598 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.946 8.6077 4.76291 0.55 protocols.relax.FastRelax: {0} CMD: min -24.6318 8.77508 5.13763 0.55 protocols.relax.FastRelax: {0} MRP: 1 -24.6318 -24.6318 8.77508 5.13763 protocols.relax.FastRelax: {0} CMD: accept_to_best -24.6318 8.77508 5.13763 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -24.6318 8.77508 5.13763 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.6318 8.77508 5.13763 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.9834 8.77508 5.13763 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 641 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.3098 8.77508 5.13763 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1373 8.77508 5.13763 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.6285 8.67703 5.14247 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.6285 8.67703 5.14247 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.051 8.67703 5.14247 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 605 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.0041 8.67703 5.14247 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.1541 8.67703 5.14247 0.154 protocols.relax.FastRelax: {0} CMD: min -37.145 8.76534 5.2012 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.145 8.76534 5.2012 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4006 8.76534 5.2012 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 597 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.4394 8.76534 5.2012 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.9138 8.76534 5.2012 0.31955 protocols.relax.FastRelax: {0} CMD: min -30.5462 8.76967 5.18806 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.5462 8.76967 5.18806 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.2434 8.76967 5.18806 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 593 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.2519 8.76967 5.18806 0.55 protocols.relax.FastRelax: {0} CMD: min -24.6041 8.91631 5.39008 0.55 protocols.relax.FastRelax: {0} MRP: 2 -24.6041 -24.6318 8.77508 5.13763 protocols.relax.FastRelax: {0} CMD: accept_to_best -24.6041 8.91631 5.39008 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -24.6041 8.91631 5.39008 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.6041 8.91631 5.39008 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1906 8.91631 5.39008 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 649 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.7024 8.91631 5.39008 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.5143 8.91631 5.39008 0.02805 protocols.relax.FastRelax: {0} CMD: min -45.4712 8.82951 5.31053 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.4712 8.82951 5.31053 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.369 8.82951 5.31053 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.6455 8.82951 5.31053 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.8684 8.82951 5.31053 0.154 protocols.relax.FastRelax: {0} CMD: min -35.6352 8.87611 5.41677 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.6352 8.87611 5.41677 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2613 8.87611 5.41677 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 597 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.9357 8.87611 5.41677 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.293 8.87611 5.41677 0.31955 protocols.relax.FastRelax: {0} CMD: min -29.1005 8.91201 5.56027 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.1005 8.91201 5.56027 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.2054 8.91201 5.56027 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 595 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.6171 8.91201 5.56027 0.55 protocols.relax.FastRelax: {0} CMD: min -24.7565 9.03094 5.36026 0.55 protocols.relax.FastRelax: {0} MRP: 3 -24.7565 -24.7565 9.03094 5.36026 protocols.relax.FastRelax: {0} CMD: accept_to_best -24.7565 9.03094 5.36026 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -24.7565 9.03094 5.36026 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.7565 9.03094 5.36026 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1924 9.03094 5.36026 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.5223 9.03094 5.36026 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.3487 9.03094 5.36026 0.02805 protocols.relax.FastRelax: {0} CMD: min -45.1586 8.91131 5.29752 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.1586 8.91131 5.29752 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.816 8.91131 5.29752 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.779 8.91131 5.29752 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.975 8.91131 5.29752 0.154 protocols.relax.FastRelax: {0} CMD: min -37.5533 9.00587 5.42698 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.5533 9.00587 5.42698 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4105 9.00587 5.42698 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.4395 9.00587 5.42698 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.8825 9.00587 5.42698 0.31955 protocols.relax.FastRelax: {0} CMD: min -30.2822 9.00351 5.45025 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.2822 9.00351 5.45025 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.0974 9.00351 5.45025 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 599 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.1531 9.00351 5.45025 0.55 protocols.relax.FastRelax: {0} CMD: min -24.7608 9.042 5.39377 0.55 protocols.relax.FastRelax: {0} MRP: 4 -24.7608 -24.7608 9.042 5.39377 protocols.relax.FastRelax: {0} CMD: accept_to_best -24.7608 9.042 5.39377 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -24.7608 9.042 5.39377 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_42.pdb protocols.relax.FastRelax: {0} CMD: repeat 13035.5 7.34355 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 13035.5 7.34355 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1835.47 7.34355 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 641 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 54.1744 7.34355 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 58.6558 7.34355 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -27.1548 7.90168 3.79488 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.1548 7.90168 3.79488 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.68147 7.90168 3.79488 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.02532 7.90168 3.79488 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.823 7.90168 3.79488 0.154 protocols.relax.FastRelax: {0} CMD: min -19.7681 7.98525 3.93499 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.7681 7.98525 3.93499 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.3973 7.98525 3.93499 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.5835 7.98525 3.93499 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.84961 7.98525 3.93499 0.31955 protocols.relax.FastRelax: {0} CMD: min -9.88714 7.98674 3.93433 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.88714 7.98674 3.93433 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.0404 7.98674 3.93433 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 3.36228 7.98674 3.93433 0.55 protocols.relax.FastRelax: {0} CMD: min -17.0002 9.9559 7.04618 0.55 protocols.relax.FastRelax: {0} MRP: 0 -17.0002 -17.0002 9.9559 7.04618 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.0002 9.9559 7.04618 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.0002 9.9559 7.04618 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.0002 9.9559 7.04618 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.8946 9.9559 7.04618 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 649 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.6467 9.9559 7.04618 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.1827 9.9559 7.04618 0.02805 protocols.relax.FastRelax: {0} CMD: min -36.2167 9.95392 7.04377 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.2167 9.95392 7.04377 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.1985 9.95392 7.04377 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.9148 9.95392 7.04377 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.5613 9.95392 7.04377 0.154 protocols.relax.FastRelax: {0} CMD: min -30.5843 9.95219 7.04148 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.5843 9.95219 7.04148 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0108 9.95219 7.04148 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.699 9.95219 7.04148 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3284 9.95219 7.04148 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.3366 9.95123 7.04025 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.3366 9.95123 7.04025 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.2754 9.95123 7.04025 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.2755 9.95123 7.04025 0.55 protocols.relax.FastRelax: {0} CMD: min -20.2155 10.0751 7.28173 0.55 protocols.relax.FastRelax: {0} MRP: 1 -20.2155 -20.2155 10.0751 7.28173 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.2155 10.0751 7.28173 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.2155 10.0751 7.28173 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.2155 10.0751 7.28173 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.2006 10.0751 7.28173 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.9403 10.0751 7.28173 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.4833 10.0751 7.28173 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.5177 10.0731 7.27925 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.5177 10.0731 7.27925 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.6366 10.0731 7.27925 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.2361 10.0731 7.27925 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.8851 10.0731 7.27925 0.154 protocols.relax.FastRelax: {0} CMD: min -31.9089 10.0713 7.27688 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.9089 10.0713 7.27688 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.3824 10.0713 7.27688 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.0368 10.0713 7.27688 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.668 10.0713 7.27688 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.676 10.0702 7.27553 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.676 10.0702 7.27553 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.6484 10.0702 7.27553 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 624 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.6484 10.0702 7.27553 0.55 protocols.relax.FastRelax: {0} CMD: min -20.2136 10.0843 7.30457 0.55 protocols.relax.FastRelax: {0} MRP: 2 -20.2136 -20.2155 10.0751 7.28173 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.2136 10.0843 7.30457 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.2136 10.0843 7.30457 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.2136 10.0843 7.30457 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.1936 10.0843 7.30457 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.6765 10.0843 7.30457 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.1704 10.0843 7.30457 0.02805 protocols.relax.FastRelax: {0} CMD: min -36.209 10.0823 7.30215 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.209 10.0823 7.30215 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.4024 10.0823 7.30215 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.7509 10.0823 7.30215 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.4017 10.0823 7.30215 0.154 protocols.relax.FastRelax: {0} CMD: min -31.4248 10.0805 7.2998 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.4248 10.0805 7.2998 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.9314 10.0805 7.2998 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.2702 10.0805 7.2998 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.8826 10.0805 7.2998 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.9128 10.0799 7.29883 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.9128 10.0799 7.29883 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.5418 10.0799 7.29883 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 624 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.1048 10.0799 7.29883 0.55 protocols.relax.FastRelax: {0} CMD: min -20.2173 10.0772 7.29295 0.55 protocols.relax.FastRelax: {0} MRP: 3 -20.2173 -20.2173 10.0772 7.29295 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.2173 10.0772 7.29295 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.2173 10.0772 7.29295 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.2173 10.0772 7.29295 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.2226 10.0772 7.29295 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 640 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.0106 10.0772 7.29295 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.5692 10.0772 7.29295 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.6031 10.0751 7.29047 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.6031 10.0751 7.29047 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.0247 10.0751 7.29047 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.9362 10.0751 7.29047 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.619 10.0751 7.29047 0.154 protocols.relax.FastRelax: {0} CMD: min -31.6356 10.073 7.28785 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.6356 10.073 7.28785 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7321 10.073 7.28785 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.0072 10.073 7.28785 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.6358 10.073 7.28785 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.6445 10.0719 7.28652 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.6445 10.0719 7.28652 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.5676 10.0719 7.28652 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 623 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.5677 10.0719 7.28652 0.55 protocols.relax.FastRelax: {0} CMD: min -20.2207 10.0678 7.28333 0.55 protocols.relax.FastRelax: {0} MRP: 4 -20.2207 -20.2207 10.0678 7.28333 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.2207 10.0678 7.28333 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.2207 10.0678 7.28333 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_38.pdb protocols.relax.FastRelax: {0} CMD: repeat 15867.2 8.65939 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15867.2 8.65939 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1936.54 8.65939 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 583 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 44.8984 8.65939 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 49.6973 8.65939 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -36.164 7.96712 3.76216 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.164 7.96712 3.76216 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.5055 7.96712 3.76216 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 670 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.2797 7.96712 3.76216 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.2483 7.96712 3.76216 0.154 protocols.relax.FastRelax: {0} CMD: min -32.0211 7.86217 5.14391 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.0211 7.86217 5.14391 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.8251 7.86217 5.14391 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.7304 7.86217 5.14391 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.0572 7.86217 5.14391 0.31955 protocols.relax.FastRelax: {0} CMD: min -29.6971 7.79344 5.6267 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.6971 7.79344 5.6267 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.9158 7.79344 5.6267 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.9841 7.79344 5.6267 0.55 protocols.relax.FastRelax: {0} CMD: min -34.1406 8.80976 7.6924 0.55 protocols.relax.FastRelax: {0} MRP: 0 -34.1406 -34.1406 8.80976 7.6924 protocols.relax.FastRelax: {0} CMD: accept_to_best -34.1406 8.80976 7.6924 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -34.1406 8.80976 7.6924 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.1406 8.80976 7.6924 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.8338 8.80976 7.6924 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 670 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.2019 8.80976 7.6924 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.9137 8.80976 7.6924 0.02805 protocols.relax.FastRelax: {0} CMD: min -50.007 8.81512 7.70172 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.007 8.81512 7.70172 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.3839 8.81512 7.70172 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -45.4497 8.81512 7.70172 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -45.183 8.81512 7.70172 0.154 protocols.relax.FastRelax: {0} CMD: min -45.2253 8.81708 7.7058 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.2253 8.81708 7.7058 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.2614 8.81708 7.7058 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.8071 8.81708 7.7058 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.479 8.81708 7.7058 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.5129 8.81305 7.7038 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.5129 8.81305 7.7038 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.2761 8.81305 7.7038 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.2761 8.81305 7.7038 0.55 protocols.relax.FastRelax: {0} CMD: min -37.9276 9.03543 8.10774 0.55 protocols.relax.FastRelax: {0} MRP: 1 -37.9276 -37.9276 9.03543 8.10774 protocols.relax.FastRelax: {0} CMD: accept_to_best -37.9276 9.03543 8.10774 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -37.9276 9.03543 8.10774 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.9276 9.03543 8.10774 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -51.8545 9.03543 8.10774 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 711 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -52.4284 9.03543 8.10774 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.1775 9.03543 8.10774 0.02805 protocols.relax.FastRelax: {0} CMD: min -52.2313 9.03514 8.11185 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.2313 9.03514 8.11185 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.3436 9.03514 8.11185 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 701 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.7178 9.03514 8.11185 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.4949 9.03514 8.11185 0.154 protocols.relax.FastRelax: {0} CMD: min -48.5199 9.03451 8.11395 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -48.5199 9.03451 8.11395 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.3627 9.03451 8.11395 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 689 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.3627 9.03451 8.11395 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.0349 9.03451 8.11395 0.31955 protocols.relax.FastRelax: {0} CMD: min -44.0413 9.03382 8.11412 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.0413 9.03382 8.11412 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.7907 9.03382 8.11412 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.7907 9.03382 8.11412 0.55 protocols.relax.FastRelax: {0} CMD: min -37.9303 9.03612 8.11158 0.55 protocols.relax.FastRelax: {0} MRP: 2 -37.9303 -37.9303 9.03612 8.11158 protocols.relax.FastRelax: {0} CMD: accept_to_best -37.9303 9.03612 8.11158 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -37.9303 9.03612 8.11158 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.9303 9.03612 8.11158 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -51.8737 9.03612 8.11158 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -52.4667 9.03612 8.11158 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.2171 9.03612 8.11158 0.02805 protocols.relax.FastRelax: {0} CMD: min -52.2703 9.0358 8.11556 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.2703 9.0358 8.11556 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.4088 9.0358 8.11556 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.7378 9.0358 8.11556 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.5145 9.0358 8.11556 0.154 protocols.relax.FastRelax: {0} CMD: min -48.5392 9.03514 8.11756 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -48.5392 9.03514 8.11756 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.3752 9.03514 8.11756 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 690 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.3752 9.03514 8.11756 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.0468 9.03514 8.11756 0.31955 protocols.relax.FastRelax: {0} CMD: min -44.0531 9.03445 8.11765 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.0531 9.03445 8.11765 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.7923 9.03445 8.11765 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 681 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.7923 9.03445 8.11765 0.55 protocols.relax.FastRelax: {0} CMD: min -37.9261 9.02312 8.10612 0.55 protocols.relax.FastRelax: {0} MRP: 3 -37.9261 -37.9303 9.03612 8.11158 protocols.relax.FastRelax: {0} CMD: accept_to_best -37.9261 9.02312 8.10612 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -37.9261 9.02312 8.10612 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.9261 9.02312 8.10612 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -51.8428 9.02312 8.10612 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -52.411 9.02312 8.10612 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.1607 9.02312 8.10612 0.02805 protocols.relax.FastRelax: {0} CMD: min -52.2137 9.02274 8.11013 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.2137 9.02274 8.11013 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.3384 9.02274 8.11013 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.714 9.02274 8.11013 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.4912 9.02274 8.11013 0.154 protocols.relax.FastRelax: {0} CMD: min -48.5158 9.02205 8.11217 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -48.5158 9.02205 8.11217 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.3607 9.02205 8.11217 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 690 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.3607 9.02205 8.11217 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.0331 9.02205 8.11217 0.31955 protocols.relax.FastRelax: {0} CMD: min -44.0393 9.02133 8.11228 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.0393 9.02133 8.11228 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.7919 9.02133 8.11228 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 681 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.7919 9.02133 8.11228 0.55 protocols.relax.FastRelax: {0} CMD: min -37.9322 9.02593 8.10668 0.55 protocols.relax.FastRelax: {0} MRP: 4 -37.9322 -37.9322 9.02593 8.10668 protocols.relax.FastRelax: {0} CMD: accept_to_best -37.9322 9.02593 8.10668 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -37.9322 9.02593 8.10668 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_37.pdb protocols.relax.FastRelax: {0} CMD: repeat 11844.2 8.11692 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 11844.2 8.11692 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1778.36 8.11692 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 585 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 103.809 8.11692 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 115.641 8.11692 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -8.2681 9.1238 3.97229 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.2681 9.1238 3.97229 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 17.9063 9.1238 3.97229 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 8.79418 9.1238 3.97229 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 10.2039 9.1238 3.97229 0.154 protocols.relax.FastRelax: {0} CMD: min -18.1741 10.2723 5.24894 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.1741 10.2723 5.24894 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.6789 10.2723 5.24894 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 646 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.6824 10.2723 5.24894 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.0919 10.2723 5.24894 0.31955 protocols.relax.FastRelax: {0} CMD: min -10.4501 10.2428 5.22445 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.4501 10.2428 5.22445 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.111942 10.2428 5.22445 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.640605 10.2428 5.22445 0.55 protocols.relax.FastRelax: {0} CMD: min -12.707 9.88055 4.88596 0.55 protocols.relax.FastRelax: {0} MRP: 0 -12.707 -12.707 9.88055 4.88596 protocols.relax.FastRelax: {0} CMD: accept_to_best -12.707 9.88055 4.88596 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -12.707 9.88055 4.88596 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.707 9.88055 4.88596 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.3145 9.88055 4.88596 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.9204 9.88055 4.88596 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.6723 9.88055 4.88596 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.3586 10.1225 5.11305 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.3586 10.1225 5.11305 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.9588 10.1225 5.11305 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.7027 10.1225 5.11305 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.9214 10.1225 5.11305 0.154 protocols.relax.FastRelax: {0} CMD: min -26.9398 9.94202 4.9387 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.9398 9.94202 4.9387 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.3156 9.94202 4.9387 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.3326 9.94202 4.9387 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.8143 9.94202 4.9387 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.5139 9.90357 4.92843 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.5139 9.90357 4.92843 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.2065 9.90357 4.92843 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.2068 9.90357 4.92843 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6264 9.72091 5.04907 0.55 protocols.relax.FastRelax: {0} MRP: 1 -17.6264 -17.6264 9.72091 5.04907 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6264 9.72091 5.04907 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6264 9.72091 5.04907 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6264 9.72091 5.04907 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.1391 9.72091 5.04907 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.4785 9.72091 5.04907 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.1212 9.72091 5.04907 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.8115 9.78173 5.02642 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.8115 9.78173 5.02642 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.3646 9.78173 5.02642 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.2546 9.78173 5.02642 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7182 9.78173 5.02642 0.154 protocols.relax.FastRelax: {0} CMD: min -26.9256 9.76283 5.03942 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.9256 9.76283 5.03942 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.4839 9.76283 5.03942 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.4841 9.76283 5.03942 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.8973 9.76283 5.03942 0.31955 protocols.relax.FastRelax: {0} CMD: min -22.6503 9.73183 5.02641 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.6503 9.73183 5.02641 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.7303 9.73183 5.02641 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 646 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.7592 9.73183 5.02641 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6351 9.71087 5.03591 0.55 protocols.relax.FastRelax: {0} MRP: 2 -17.6351 -17.6351 9.71087 5.03591 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6351 9.71087 5.03591 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6351 9.71087 5.03591 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6351 9.71087 5.03591 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.1503 9.71087 5.03591 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.5234 9.71087 5.03591 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.1723 9.71087 5.03591 0.02805 protocols.relax.FastRelax: {0} CMD: min -38.3711 9.82555 5.1264 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.3711 9.82555 5.1264 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.064 9.82555 5.1264 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 650 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.108 9.82555 5.1264 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.1544 9.82555 5.1264 0.154 protocols.relax.FastRelax: {0} CMD: min -26.7455 9.75644 5.06921 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.7455 9.75644 5.06921 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.7325 9.75644 5.06921 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 667 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.7497 9.75644 5.06921 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.1206 9.75644 5.06921 0.31955 protocols.relax.FastRelax: {0} CMD: min -18.8652 9.70984 5.03382 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.8652 9.70984 5.03382 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.3066 9.70984 5.03382 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 660 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.30679 9.70984 5.03382 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6358 9.7144 5.04678 0.55 protocols.relax.FastRelax: {0} MRP: 3 -17.6358 -17.6358 9.7144 5.04678 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6358 9.7144 5.04678 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6358 9.7144 5.04678 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6358 9.7144 5.04678 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.1673 9.7144 5.04678 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.5486 9.7144 5.04678 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.1895 9.7144 5.04678 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.4092 9.77215 4.98803 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.4092 9.77215 4.98803 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.5483 9.77215 4.98803 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 649 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.198 9.77215 4.98803 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.4325 9.77215 4.98803 0.154 protocols.relax.FastRelax: {0} CMD: min -28.2551 9.73769 5.02654 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.2551 9.73769 5.02654 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.395 9.73769 5.02654 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 649 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.6019 9.73769 5.02654 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.1303 9.73769 5.02654 0.31955 protocols.relax.FastRelax: {0} CMD: min -22.5756 9.71458 5.01514 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.5756 9.71458 5.01514 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.6399 9.71458 5.01514 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.646 9.71458 5.01514 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6405 9.71385 5.04012 0.55 protocols.relax.FastRelax: {0} MRP: 4 -17.6405 -17.6405 9.71385 5.04012 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6405 9.71385 5.04012 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6405 9.71385 5.04012 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_31.pdb protocols.relax.FastRelax: {0} CMD: repeat 16509.6 9.91003 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16509.6 9.91003 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2500.04 9.91003 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 56.1602 9.91003 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 60.0416 9.91003 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -38.0092 10.2647 3.71993 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.0092 10.2647 3.71993 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.5098 10.2647 3.71993 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 595 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.6564 10.2647 3.71993 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.3784 10.2647 3.71993 0.154 protocols.relax.FastRelax: {0} CMD: min -40.2651 10.3029 4.21116 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.2651 10.3029 4.21116 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.7739 10.3029 4.21116 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 606 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.2688 10.3029 4.21116 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.547 10.3029 4.21116 0.31955 protocols.relax.FastRelax: {0} CMD: min -31.0319 10.2945 4.2021 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.0319 10.2945 4.2021 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.2737 10.2945 4.2021 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 599 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.2825 10.2945 4.2021 0.55 protocols.relax.FastRelax: {0} CMD: min -29.4512 10.2145 4.20173 0.55 protocols.relax.FastRelax: {0} MRP: 0 -29.4512 -29.4512 10.2145 4.20173 protocols.relax.FastRelax: {0} CMD: accept_to_best -29.4512 10.2145 4.20173 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -29.4512 10.2145 4.20173 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.4512 10.2145 4.20173 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.556 10.2145 4.20173 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 654 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.9557 10.2145 4.20173 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.1224 10.2145 4.20173 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.7112 10.2796 4.17227 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.7112 10.2796 4.17227 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.2295 10.2796 4.17227 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 615 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.6237 10.2796 4.17227 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.8356 10.2796 4.17227 0.154 protocols.relax.FastRelax: {0} CMD: min -45.8563 10.2185 4.14034 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.8563 10.2185 4.14034 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.2872 10.2185 4.14034 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 595 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.2885 10.2185 4.14034 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.6131 10.2185 4.14034 0.31955 protocols.relax.FastRelax: {0} CMD: min -38.0598 10.2161 4.15589 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.0598 10.2161 4.15589 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.8263 10.2161 4.15589 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 592 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.8598 10.2161 4.15589 0.55 protocols.relax.FastRelax: {0} CMD: min -30.7279 10.2343 4.39437 0.55 protocols.relax.FastRelax: {0} MRP: 1 -30.7279 -30.7279 10.2343 4.39437 protocols.relax.FastRelax: {0} CMD: accept_to_best -30.7279 10.2343 4.39437 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -30.7279 10.2343 4.39437 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.7279 10.2343 4.39437 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.7698 10.2343 4.39437 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.7445 10.2343 4.39437 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.7403 10.2343 4.39437 0.02805 protocols.relax.FastRelax: {0} CMD: min -59.2615 10.2462 4.39093 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -59.2615 10.2462 4.39093 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.4924 10.2462 4.39093 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 628 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.7327 10.2462 4.39093 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.5071 10.2462 4.39093 0.154 protocols.relax.FastRelax: {0} CMD: min -47.2324 10.2259 4.26926 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.2324 10.2259 4.26926 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.3731 10.2259 4.26926 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 613 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.8182 10.2259 4.26926 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.0314 10.2259 4.26926 0.31955 protocols.relax.FastRelax: {0} CMD: min -37.994 10.1997 4.26293 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.994 10.1997 4.26293 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.8595 10.1997 4.26293 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 611 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.8595 10.1997 4.26293 0.55 protocols.relax.FastRelax: {0} CMD: min -32.5456 10.1613 4.0824 0.55 protocols.relax.FastRelax: {0} MRP: 2 -32.5456 -32.5456 10.1613 4.0824 protocols.relax.FastRelax: {0} CMD: accept_to_best -32.5456 10.1613 4.0824 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -32.5456 10.1613 4.0824 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.5456 10.1613 4.0824 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.5925 10.1613 4.0824 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -51.0362 10.1613 4.0824 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -50.2097 10.1613 4.0824 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.9255 10.203 4.13002 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.9255 10.203 4.13002 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.8865 10.203 4.13002 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 619 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.4516 10.203 4.13002 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.6511 10.203 4.13002 0.154 protocols.relax.FastRelax: {0} CMD: min -46.5893 10.1959 4.14238 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.5893 10.1959 4.14238 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.7474 10.1959 4.14238 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 598 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.7474 10.1959 4.14238 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.129 10.1959 4.14238 0.31955 protocols.relax.FastRelax: {0} CMD: min -39.5574 10.1622 4.08608 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.5574 10.1622 4.08608 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.2256 10.1622 4.08608 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 592 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.2284 10.1622 4.08608 0.55 protocols.relax.FastRelax: {0} CMD: min -32.6465 10.1627 4.09999 0.55 protocols.relax.FastRelax: {0} MRP: 3 -32.6465 -32.6465 10.1627 4.09999 protocols.relax.FastRelax: {0} CMD: accept_to_best -32.6465 10.1627 4.09999 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -32.6465 10.1627 4.09999 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.6465 10.1627 4.09999 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.6476 10.1627 4.09999 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.5561 10.1627 4.09999 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.6705 10.1627 4.09999 0.02805 protocols.relax.FastRelax: {0} CMD: min -58.0776 10.1738 4.11061 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -58.0776 10.1738 4.11061 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.0442 10.1738 4.11061 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 602 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.8732 10.1738 4.11061 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.7336 10.1738 4.11061 0.154 protocols.relax.FastRelax: {0} CMD: min -47.6928 10.1625 4.10002 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.6928 10.1625 4.10002 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.0672 10.1625 4.10002 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.0998 10.1625 4.10002 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.4162 10.1625 4.10002 0.31955 protocols.relax.FastRelax: {0} CMD: min -39.3871 10.1408 4.10286 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.3871 10.1408 4.10286 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.027 10.1408 4.10286 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 591 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.1443 10.1408 4.10286 0.55 protocols.relax.FastRelax: {0} CMD: min -32.6563 10.1616 4.08999 0.55 protocols.relax.FastRelax: {0} MRP: 4 -32.6563 -32.6563 10.1616 4.08999 protocols.relax.FastRelax: {0} CMD: accept_to_best -32.6563 10.1616 4.08999 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -32.6563 10.1616 4.08999 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_3.pdb protocols.relax.FastRelax: {0} CMD: repeat 14028 8.63802 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14028 8.63802 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1924.5 8.63802 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 571 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 123.747 8.63802 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 132.549 8.63802 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 9.04236 7.5811 4.25865 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 9.04236 7.5811 4.25865 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 27.7446 7.5811 4.25865 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 597 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 26.4204 7.5811 4.25865 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 27.6975 7.5811 4.25865 0.154 protocols.relax.FastRelax: {0} CMD: min 15.3689 7.44366 4.73812 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15.3689 7.44366 4.73812 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 25.9449 7.44366 4.73812 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 601 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 23.0207 7.44366 4.73812 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 23.8022 7.44366 4.73812 0.31955 protocols.relax.FastRelax: {0} CMD: min 12.9347 7.68236 4.26892 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 12.9347 7.68236 4.26892 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 21.4471 7.68236 4.26892 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 582 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 21.3649 7.68236 4.26892 0.55 protocols.relax.FastRelax: {0} CMD: min 6.56084 6.62511 7.14687 0.55 protocols.relax.FastRelax: {0} MRP: 0 6.56084 6.56084 6.62511 7.14687 protocols.relax.FastRelax: {0} CMD: accept_to_best 6.56084 6.62511 7.14687 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 6.56084 6.62511 7.14687 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 6.56084 6.62511 7.14687 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.2564 6.62511 7.14687 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 694 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.9143 6.62511 7.14687 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.5124 6.62511 7.14687 0.02805 protocols.relax.FastRelax: {0} CMD: min -19.5486 6.47204 7.73211 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.5486 6.47204 7.73211 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.89811 6.47204 7.73211 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -1.92035 6.47204 7.73211 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.684824 6.47204 7.73211 0.154 protocols.relax.FastRelax: {0} CMD: min -10.2431 6.56522 7.37153 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.2431 6.56522 7.37153 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.89946 6.56522 7.37153 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -1.90105 6.56522 7.37153 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.24323 6.56522 7.37153 0.31955 protocols.relax.FastRelax: {0} CMD: min -3.49245 6.60188 7.16467 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -3.49245 6.60188 7.16467 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 5.16554 6.60188 7.16467 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 669 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 5.16554 6.60188 7.16467 0.55 protocols.relax.FastRelax: {0} CMD: min 3.85839 6.61155 7.20535 0.55 protocols.relax.FastRelax: {0} MRP: 1 3.85839 3.85839 6.61155 7.20535 protocols.relax.FastRelax: {0} CMD: accept_to_best 3.85839 6.61155 7.20535 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 3.85839 6.61155 7.20535 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 3.85839 6.61155 7.20535 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.9861 6.61155 7.20535 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.5243 6.61155 7.20535 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.3279 6.61155 7.20535 0.02805 protocols.relax.FastRelax: {0} CMD: min -19.3716 6.45718 7.7916 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.3716 6.45718 7.7916 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.25804 6.45718 7.7916 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -3.2796 6.45718 7.7916 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.14906 6.45718 7.7916 0.154 protocols.relax.FastRelax: {0} CMD: min -8.83922 6.49591 7.53953 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.83922 6.49591 7.53953 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 0.64585 6.49591 7.53953 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 670 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 0.6435 6.49591 7.53953 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1.39123 6.49591 7.53953 0.31955 protocols.relax.FastRelax: {0} CMD: min -3.64204 6.58697 7.24851 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -3.64204 6.58697 7.24851 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.98208 6.58697 7.24851 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 687 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 4.96173 6.58697 7.24851 0.55 protocols.relax.FastRelax: {0} CMD: min 3.78949 6.60875 7.20345 0.55 protocols.relax.FastRelax: {0} MRP: 2 3.78949 3.78949 6.60875 7.20345 protocols.relax.FastRelax: {0} CMD: accept_to_best 3.78949 6.60875 7.20345 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 3.78949 6.60875 7.20345 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 3.78949 6.60875 7.20345 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.9456 6.60875 7.20345 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.5023 6.60875 7.20345 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.3056 6.60875 7.20345 0.02805 protocols.relax.FastRelax: {0} CMD: min -20.1305 6.46565 7.75546 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.1305 6.46565 7.75546 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.61641 6.46565 7.75546 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 653 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -3.61641 6.46565 7.75546 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.45888 6.46565 7.75546 0.154 protocols.relax.FastRelax: {0} CMD: min -10.7454 6.5387 7.44267 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.7454 6.5387 7.44267 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.44432 6.5387 7.44267 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 689 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.44432 6.5387 7.44267 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.78975 6.5387 7.44267 0.31955 protocols.relax.FastRelax: {0} CMD: min -3.59542 6.58903 7.21065 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -3.59542 6.58903 7.21065 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 5.30019 6.58903 7.21065 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 687 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 5.28091 6.58903 7.21065 0.55 protocols.relax.FastRelax: {0} CMD: min 3.7899 6.61368 7.20529 0.55 protocols.relax.FastRelax: {0} MRP: 3 3.7899 3.78949 6.60875 7.20345 protocols.relax.FastRelax: {0} CMD: accept_to_best 3.7899 6.61368 7.20529 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 3.7899 6.61368 7.20529 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 3.7899 6.61368 7.20529 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.9728 6.61368 7.20529 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.5331 6.61368 7.20529 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.336 6.61368 7.20529 0.02805 protocols.relax.FastRelax: {0} CMD: min -19.5222 6.45218 7.77262 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.5222 6.45218 7.77262 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.48865 6.45218 7.77262 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 669 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -3.48963 6.45218 7.77262 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.36598 6.45218 7.77262 0.154 protocols.relax.FastRelax: {0} CMD: min -10.6655 6.51881 7.46435 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.6655 6.51881 7.46435 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.52773 6.51881 7.46435 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 692 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.52773 6.51881 7.46435 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.88604 6.51881 7.46435 0.31955 protocols.relax.FastRelax: {0} CMD: min -3.67583 6.5983 7.22213 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -3.67583 6.5983 7.22213 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.9371 6.5983 7.22213 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 688 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 4.90211 6.5983 7.22213 0.55 protocols.relax.FastRelax: {0} CMD: min 3.79002 6.61481 7.20516 0.55 protocols.relax.FastRelax: {0} MRP: 4 3.79002 3.78949 6.60875 7.20345 protocols.relax.FastRelax: {0} CMD: accept_to_best 3.79002 6.61481 7.20516 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 3.79002 6.61481 7.20516 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_15.pdb protocols.relax.FastRelax: {0} CMD: repeat 13540.7 8.62467 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 13540.7 8.62467 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2122.69 8.62467 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 71.8173 8.62467 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 73.4166 8.62467 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -18.3822 9.55107 4.01507 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.3822 9.55107 4.01507 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 5.4685 9.55107 4.01507 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.1411 9.55107 4.01507 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.4924 9.55107 4.01507 0.154 protocols.relax.FastRelax: {0} CMD: min -26.9079 8.83229 3.4664 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.9079 8.83229 3.4664 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7757 8.83229 3.4664 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 623 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.9104 8.83229 3.4664 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.431 8.83229 3.4664 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.7039 8.81863 3.45155 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.7039 8.81863 3.45155 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.0507 8.81863 3.45155 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 614 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.0801 8.81863 3.45155 0.55 protocols.relax.FastRelax: {0} CMD: min -21.3052 8.42721 3.28692 0.55 protocols.relax.FastRelax: {0} MRP: 0 -21.3052 -21.3052 8.42721 3.28692 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.3052 8.42721 3.28692 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.3052 8.42721 3.28692 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.3052 8.42721 3.28692 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4273 8.42721 3.28692 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.0579 8.42721 3.28692 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.5415 8.42721 3.28692 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.118 8.45186 3.30678 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.118 8.45186 3.30678 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.2899 8.45186 3.30678 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 665 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.6642 8.45186 3.30678 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4207 8.45186 3.30678 0.154 protocols.relax.FastRelax: {0} CMD: min -30.4612 8.45126 3.30798 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.4612 8.45126 3.30798 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.947 8.45126 3.30798 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.947 8.45126 3.30798 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.591 8.45126 3.30798 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.8308 8.43636 3.28667 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.8308 8.43636 3.28667 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.5873 8.43636 3.28667 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 649 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.5873 8.43636 3.28667 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2259 8.48971 3.16324 0.55 protocols.relax.FastRelax: {0} MRP: 1 -21.2259 -21.3052 8.42721 3.28692 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2259 8.48971 3.16324 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2259 8.48971 3.16324 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2259 8.48971 3.16324 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.3284 8.48971 3.16324 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 664 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.6964 8.48971 3.16324 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.1441 8.48971 3.16324 0.02805 protocols.relax.FastRelax: {0} CMD: min -33.7435 8.51054 3.18358 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.7435 8.51054 3.18358 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.2696 8.51054 3.18358 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 652 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.9399 8.51054 3.18358 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.7157 8.51054 3.18358 0.154 protocols.relax.FastRelax: {0} CMD: min -30.7455 8.50822 3.18445 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.7455 8.50822 3.18445 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.5752 8.50822 3.18445 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.5752 8.50822 3.18445 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2464 8.50822 3.18445 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.4192 8.48796 3.16354 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.4192 8.48796 3.16354 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.6519 8.48796 3.16354 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.6519 8.48796 3.16354 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2233 8.49523 3.16733 0.55 protocols.relax.FastRelax: {0} MRP: 2 -21.2233 -21.3052 8.42721 3.28692 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2233 8.49523 3.16733 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2233 8.49523 3.16733 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2233 8.49523 3.16733 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.336 8.49523 3.16733 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.5986 8.49523 3.16733 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4514 8.49523 3.16733 0.02805 protocols.relax.FastRelax: {0} CMD: min -38.2607 8.50555 3.33766 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.2607 8.50555 3.33766 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.6093 8.50555 3.33766 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.6398 8.50555 3.33766 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.9654 8.50555 3.33766 0.154 protocols.relax.FastRelax: {0} CMD: min -31.9552 8.50533 3.26095 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.9552 8.50533 3.26095 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9361 8.50533 3.26095 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9745 8.50533 3.26095 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5016 8.50533 3.26095 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.4701 8.50363 3.24048 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.4701 8.50363 3.24048 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.1429 8.50363 3.24048 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 616 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.1432 8.50363 3.24048 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2181 8.50259 3.18898 0.55 protocols.relax.FastRelax: {0} MRP: 3 -21.2181 -21.3052 8.42721 3.28692 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2181 8.50259 3.18898 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2181 8.50259 3.18898 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2181 8.50259 3.18898 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.3874 8.50259 3.18898 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.7112 8.50259 3.18898 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.5439 8.50259 3.18898 0.02805 protocols.relax.FastRelax: {0} CMD: min -32.8397 8.49583 3.17985 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.8397 8.49583 3.17985 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.5235 8.49583 3.17985 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 654 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.4287 8.49583 3.17985 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.2309 8.49583 3.17985 0.154 protocols.relax.FastRelax: {0} CMD: min -30.9236 8.50819 3.20736 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.9236 8.50819 3.20736 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.7433 8.50819 3.20736 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.7433 8.50819 3.20736 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.4137 8.50819 3.20736 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.5156 8.49573 3.19222 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.5156 8.49573 3.19222 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5881 8.49573 3.19222 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.5881 8.49573 3.19222 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2227 8.5119 3.20332 0.55 protocols.relax.FastRelax: {0} MRP: 4 -21.2227 -21.3052 8.42721 3.28692 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2227 8.5119 3.20332 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2227 8.5119 3.20332 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_29.pdb protocols.relax.FastRelax: {0} CMD: repeat 12542.7 7.6303 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 12542.7 7.6303 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1771.47 7.6303 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 551 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 61.8981 7.6303 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 68.8675 7.6303 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -30.1972 7.67808 3.90593 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.1972 7.67808 3.90593 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.89848 7.67808 3.90593 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.7647 7.67808 3.90593 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.24377 7.67808 3.90593 0.154 protocols.relax.FastRelax: {0} CMD: min -20.1956 7.74143 3.91658 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.1956 7.74143 3.91658 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.09167 7.74143 3.91658 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.12748 7.74143 3.91658 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.25366 7.74143 3.91658 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.8663 8.2198 5.26966 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.8663 8.2198 5.26966 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.9937 8.2198 5.26966 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 683 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.2705 8.2198 5.26966 0.55 protocols.relax.FastRelax: {0} CMD: min -23.4908 9.23147 7.30422 0.55 protocols.relax.FastRelax: {0} MRP: 0 -23.4908 -23.4908 9.23147 7.30422 protocols.relax.FastRelax: {0} CMD: accept_to_best -23.4908 9.23147 7.30422 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -23.4908 9.23147 7.30422 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.4908 9.23147 7.30422 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.984 9.23147 7.30422 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 812 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -43.883 9.23147 7.30422 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.6409 9.23147 7.30422 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.7747 9.22557 7.2965 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.7747 9.22557 7.2965 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.0247 9.22557 7.2965 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 765 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.0248 9.22557 7.2965 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.6918 9.22557 7.2965 0.154 protocols.relax.FastRelax: {0} CMD: min -38.7448 9.22208 7.2919 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.7448 9.22208 7.2919 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.5226 9.22208 7.2919 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 742 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.5227 9.22208 7.2919 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.032 9.22208 7.2919 0.31955 protocols.relax.FastRelax: {0} CMD: min -32.0518 9.22157 7.29111 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.0518 9.22157 7.29111 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.7109 9.22157 7.29111 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.7109 9.22157 7.29111 0.55 protocols.relax.FastRelax: {0} CMD: min -26.3116 9.59002 7.78126 0.55 protocols.relax.FastRelax: {0} MRP: 1 -26.3116 -26.3116 9.59002 7.78126 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.3116 9.59002 7.78126 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.3116 9.59002 7.78126 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.3116 9.59002 7.78126 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.2442 9.59002 7.78126 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 812 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.7043 9.59002 7.78126 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.4738 9.59002 7.78126 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.6199 9.58321 7.77222 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.6199 9.58321 7.77222 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.1002 9.58321 7.77222 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 764 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.1003 9.58321 7.77222 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.7835 9.58321 7.77222 0.154 protocols.relax.FastRelax: {0} CMD: min -39.8473 9.57892 7.76661 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.8473 9.57892 7.76661 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9224 9.57892 7.76661 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 743 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.9225 9.57892 7.76661 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4553 9.57892 7.76661 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.4678 9.57776 7.76517 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4678 9.57776 7.76517 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.5559 9.57776 7.76517 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.5559 9.57776 7.76517 0.55 protocols.relax.FastRelax: {0} CMD: min -26.311 9.60173 7.79 0.55 protocols.relax.FastRelax: {0} MRP: 2 -26.311 -26.3116 9.59002 7.78126 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.311 9.60173 7.79 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.311 9.60173 7.79 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.311 9.60173 7.79 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.2332 9.60173 7.79 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 811 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.6671 9.60173 7.79 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.4386 9.60173 7.79 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.5835 9.59493 7.78098 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.5835 9.59493 7.78098 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.1014 9.59493 7.78098 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 763 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.1015 9.59493 7.78098 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.7873 9.59493 7.78098 0.154 protocols.relax.FastRelax: {0} CMD: min -39.8503 9.59066 7.77539 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.8503 9.59066 7.77539 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9747 9.59066 7.77539 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 742 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.9748 9.59066 7.77539 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.5114 9.59066 7.77539 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.5235 9.58951 7.77396 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.5235 9.58951 7.77396 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.6854 9.58951 7.77396 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 711 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.6854 9.58951 7.77396 0.55 protocols.relax.FastRelax: {0} CMD: min -26.3162 9.59994 7.79174 0.55 protocols.relax.FastRelax: {0} MRP: 3 -26.3162 -26.3162 9.59994 7.79174 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.3162 9.59994 7.79174 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.3162 9.59994 7.79174 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.3162 9.59994 7.79174 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.2353 9.59994 7.79174 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 812 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.6859 9.59994 7.79174 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.4564 9.59994 7.79174 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.6018 9.59313 7.78271 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.6018 9.59313 7.78271 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.0993 9.59313 7.78271 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 764 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.0994 9.59313 7.78271 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.7838 9.59313 7.78271 0.154 protocols.relax.FastRelax: {0} CMD: min -39.8468 9.58884 7.77709 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.8468 9.58884 7.77709 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9447 9.58884 7.77709 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 743 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.9447 9.58884 7.77709 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4793 9.58884 7.77709 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.4916 9.58766 7.77562 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4916 9.58766 7.77562 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.6138 9.58766 7.77562 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.6138 9.58766 7.77562 0.55 protocols.relax.FastRelax: {0} CMD: min -26.317 9.60024 7.79122 0.55 protocols.relax.FastRelax: {0} MRP: 4 -26.317 -26.317 9.60024 7.79122 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.317 9.60024 7.79122 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.317 9.60024 7.79122 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_8.pdb protocols.relax.FastRelax: {0} CMD: repeat 14556.1 6.86966 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14556.1 6.86966 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2169.75 6.86966 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 153.78 6.86966 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 182.128 6.86966 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.4159 6.51461 3.50894 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.4159 6.51461 3.50894 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.396768 6.51461 3.50894 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 732 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.9024 6.51461 3.50894 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.4471 6.51461 3.50894 0.154 protocols.relax.FastRelax: {0} CMD: min -35.2042 6.49832 3.39261 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.2042 6.49832 3.39261 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2777 6.49832 3.39261 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 739 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.3146 6.49832 3.39261 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.5288 6.49832 3.39261 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.9454 6.50393 3.36527 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.9454 6.50393 3.36527 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7489 6.50393 3.36527 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 736 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7594 6.50393 3.36527 0.55 protocols.relax.FastRelax: {0} CMD: min -26.8057 6.57343 3.65422 0.55 protocols.relax.FastRelax: {0} MRP: 0 -26.8057 -26.8057 6.57343 3.65422 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.8057 6.57343 3.65422 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.8057 6.57343 3.65422 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.8057 6.57343 3.65422 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.0362 6.57343 3.65422 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 779 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -43.7778 6.57343 3.65422 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.4501 6.57343 3.65422 0.02805 protocols.relax.FastRelax: {0} CMD: min -51.9601 6.6294 3.83085 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -51.9601 6.6294 3.83085 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2733 6.6294 3.83085 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 777 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.6916 6.6294 3.83085 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.2848 6.6294 3.83085 0.154 protocols.relax.FastRelax: {0} CMD: min -41.6182 6.60741 3.79805 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.6182 6.60741 3.79805 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.256 6.60741 3.79805 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 725 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.2983 6.60741 3.79805 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.5647 6.60741 3.79805 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.1432 6.61725 3.75555 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.1432 6.61725 3.75555 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.6743 6.61725 3.75555 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 721 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.6743 6.61725 3.75555 0.55 protocols.relax.FastRelax: {0} CMD: min -31.4605 6.72282 4.18978 0.55 protocols.relax.FastRelax: {0} MRP: 1 -31.4605 -31.4605 6.72282 4.18978 protocols.relax.FastRelax: {0} CMD: accept_to_best -31.4605 6.72282 4.18978 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -31.4605 6.72282 4.18978 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.4605 6.72282 4.18978 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -45.8468 6.72282 4.18978 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 855 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.3671 6.72282 4.18978 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.9399 6.72282 4.18978 0.02805 protocols.relax.FastRelax: {0} CMD: min -59.9026 6.79919 4.53852 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -59.9026 6.79919 4.53852 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.484 6.79919 4.53852 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 772 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.366 6.79919 4.53852 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.1189 6.79919 4.53852 0.154 protocols.relax.FastRelax: {0} CMD: min -45.9405 6.78563 4.49137 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.9405 6.78563 4.49137 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.532 6.78563 4.49137 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 752 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.6138 6.78563 4.49137 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.9302 6.78563 4.49137 0.31955 protocols.relax.FastRelax: {0} CMD: min -38.6361 6.80842 4.52805 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.6361 6.80842 4.52805 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.3847 6.80842 4.52805 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 746 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.3946 6.80842 4.52805 0.55 protocols.relax.FastRelax: {0} CMD: min -38.4348 7.40283 5.57672 0.55 protocols.relax.FastRelax: {0} MRP: 2 -38.4348 -38.4348 7.40283 5.57672 protocols.relax.FastRelax: {0} CMD: accept_to_best -38.4348 7.40283 5.57672 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -38.4348 7.40283 5.57672 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.4348 7.40283 5.57672 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -53.8365 7.40283 5.57672 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 885 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -55.6913 7.40283 5.57672 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -55.2246 7.40283 5.57672 0.02805 protocols.relax.FastRelax: {0} CMD: min -58.7422 7.38075 5.57955 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -58.7422 7.38075 5.57955 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.6258 7.38075 5.57955 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 766 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.7375 7.38075 5.57955 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.6517 7.38075 5.57955 0.154 protocols.relax.FastRelax: {0} CMD: min -51.3133 7.48899 5.73124 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -51.3133 7.48899 5.73124 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.9109 7.48899 5.73124 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 737 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.9685 7.48899 5.73124 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.2262 7.48899 5.73124 0.31955 protocols.relax.FastRelax: {0} CMD: min -42.0549 7.45051 5.68373 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.0549 7.45051 5.68373 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.1718 7.45051 5.68373 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 729 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.7965 7.45051 5.68373 0.55 protocols.relax.FastRelax: {0} CMD: min -41.9321 7.75144 6.10885 0.55 protocols.relax.FastRelax: {0} MRP: 3 -41.9321 -41.9321 7.75144 6.10885 protocols.relax.FastRelax: {0} CMD: accept_to_best -41.9321 7.75144 6.10885 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -41.9321 7.75144 6.10885 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.9321 7.75144 6.10885 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -56.7592 7.75144 6.10885 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 899 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -58.4579 7.75144 6.10885 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -57.6538 7.75144 6.10885 0.02805 protocols.relax.FastRelax: {0} CMD: min -62.1705 7.72638 6.15035 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -62.1705 7.72638 6.15035 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.5454 7.72638 6.15035 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 758 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.7891 7.72638 6.15035 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.9632 7.72638 6.15035 0.154 protocols.relax.FastRelax: {0} CMD: min -54.2744 7.88204 6.3221 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.2744 7.88204 6.3221 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.257 7.88204 6.3221 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 751 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -46.4419 7.88204 6.3221 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -45.8243 7.88204 6.3221 0.31955 protocols.relax.FastRelax: {0} CMD: min -47.9442 7.79734 6.17603 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.9442 7.79734 6.17603 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1981 7.79734 6.17603 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 746 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.1982 7.79734 6.17603 0.55 protocols.relax.FastRelax: {0} CMD: min -41.9377 7.77052 6.13454 0.55 protocols.relax.FastRelax: {0} MRP: 4 -41.9377 -41.9377 7.77052 6.13454 protocols.relax.FastRelax: {0} CMD: accept_to_best -41.9377 7.77052 6.13454 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -41.9377 7.77052 6.13454 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_9.pdb protocols.relax.FastRelax: {0} CMD: repeat 14542 7.53711 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14542 7.53711 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1854.41 7.53711 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 648 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 56.4246 7.53711 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 61.105 7.53711 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -14.7786 7.62257 5.30642 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.7786 7.62257 5.30642 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 34.3268 7.62257 5.30642 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 611 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 29.6165 7.62257 5.30642 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 32.9517 7.62257 5.30642 0.154 protocols.relax.FastRelax: {0} CMD: min -16.7282 7.35734 4.67673 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.7282 7.35734 4.67673 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.66663 7.35734 4.67673 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.9824 7.35734 4.67673 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.3798 7.35734 4.67673 0.31955 protocols.relax.FastRelax: {0} CMD: min -11.4364 7.35401 4.68378 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.4364 7.35401 4.68378 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.0292778 7.35401 4.68378 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 664 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.610523 7.35401 4.68378 0.55 protocols.relax.FastRelax: {0} CMD: min -21.227 7.69283 3.72315 0.55 protocols.relax.FastRelax: {0} MRP: 0 -21.227 -21.227 7.69283 3.72315 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.227 7.69283 3.72315 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.227 7.69283 3.72315 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.227 7.69283 3.72315 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.0452 7.69283 3.72315 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.9014 7.69283 3.72315 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.4197 7.69283 3.72315 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.4956 7.69993 3.72786 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.4956 7.69993 3.72786 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.1183 7.69993 3.72786 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 654 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.338 7.69993 3.72786 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.9251 7.69993 3.72786 0.154 protocols.relax.FastRelax: {0} CMD: min -36.2473 7.68924 3.68515 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.2473 7.68924 3.68515 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.1606 7.68924 3.68515 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 650 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.8404 7.68924 3.68515 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.3625 7.68924 3.68515 0.31955 protocols.relax.FastRelax: {0} CMD: min -32.9979 7.86222 4.21396 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.9979 7.86222 4.21396 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0313 7.86222 4.21396 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 641 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.0855 7.86222 4.21396 0.55 protocols.relax.FastRelax: {0} CMD: min -30.6456 7.92172 5.25016 0.55 protocols.relax.FastRelax: {0} MRP: 1 -30.6456 -30.6456 7.92172 5.25016 protocols.relax.FastRelax: {0} CMD: accept_to_best -30.6456 7.92172 5.25016 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -30.6456 7.92172 5.25016 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.6456 7.92172 5.25016 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.9981 7.92172 5.25016 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 675 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.5209 7.92172 5.25016 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.0906 7.92172 5.25016 0.02805 protocols.relax.FastRelax: {0} CMD: min -48.3343 7.93781 5.25819 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -48.3343 7.93781 5.25819 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.9555 7.93781 5.25819 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 660 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.9748 7.93781 5.25819 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.6386 7.93781 5.25819 0.154 protocols.relax.FastRelax: {0} CMD: min -42.6896 7.93778 5.26846 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.6896 7.93778 5.26846 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.4782 7.93778 5.26846 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.4793 7.93778 5.26846 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.9899 7.93778 5.26846 0.31955 protocols.relax.FastRelax: {0} CMD: min -37.0784 7.92853 5.25607 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.0784 7.92853 5.25607 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.8242 7.92853 5.25607 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 652 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.8245 7.92853 5.25607 0.55 protocols.relax.FastRelax: {0} CMD: min -30.7703 7.966 5.41865 0.55 protocols.relax.FastRelax: {0} MRP: 2 -30.7703 -30.7703 7.966 5.41865 protocols.relax.FastRelax: {0} CMD: accept_to_best -30.7703 7.966 5.41865 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -30.7703 7.966 5.41865 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.7703 7.966 5.41865 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.9999 7.966 5.41865 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.1257 7.966 5.41865 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.7898 7.966 5.41865 0.02805 protocols.relax.FastRelax: {0} CMD: min -48.9453 7.97871 5.42608 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -48.9453 7.97871 5.42608 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.3606 7.97871 5.42608 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -43.1237 7.97871 5.42608 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.7933 7.97871 5.42608 0.154 protocols.relax.FastRelax: {0} CMD: min -42.8434 7.97985 5.435 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.8434 7.97985 5.435 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.7267 7.97985 5.435 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.7268 7.97985 5.435 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.2445 7.97985 5.435 0.31955 protocols.relax.FastRelax: {0} CMD: min -37.3905 7.97998 5.43875 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.3905 7.97998 5.43875 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.1875 7.97998 5.43875 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.1876 7.97998 5.43875 0.55 protocols.relax.FastRelax: {0} CMD: min -31.8335 7.90839 5.30456 0.55 protocols.relax.FastRelax: {0} MRP: 3 -31.8335 -31.8335 7.90839 5.30456 protocols.relax.FastRelax: {0} CMD: accept_to_best -31.8335 7.90839 5.30456 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -31.8335 7.90839 5.30456 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.8335 7.90839 5.30456 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.1508 7.90839 5.30456 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -51.0746 7.90839 5.30456 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -50.6992 7.90839 5.30456 0.02805 protocols.relax.FastRelax: {0} CMD: min -50.8851 7.92304 5.31394 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.8851 7.92304 5.31394 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.5273 7.92304 5.31394 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.5061 7.92304 5.31394 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.1727 7.92304 5.31394 0.154 protocols.relax.FastRelax: {0} CMD: min -44.2344 7.92401 5.32408 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.2344 7.92401 5.32408 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.064 7.92401 5.32408 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 654 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.0641 7.92401 5.32408 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.5776 7.92401 5.32408 0.31955 protocols.relax.FastRelax: {0} CMD: min -38.2969 7.93563 5.31701 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.2969 7.93563 5.31701 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.7688 7.93563 5.31701 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 648 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.7689 7.93563 5.31701 0.55 protocols.relax.FastRelax: {0} CMD: min -32.3267 7.97063 5.48598 0.55 protocols.relax.FastRelax: {0} MRP: 4 -32.3267 -32.3267 7.97063 5.48598 protocols.relax.FastRelax: {0} CMD: accept_to_best -32.3267 7.97063 5.48598 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -32.3267 7.97063 5.48598 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_43.pdb protocols.relax.FastRelax: {0} CMD: repeat 14307.7 8.27139 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14307.7 8.27139 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1804.6 8.27139 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 94.2085 8.27139 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 101.997 8.27139 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -10.37 8.35871 3.37028 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.37 8.35871 3.37028 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 12.3022 8.35871 3.37028 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 8.06917 8.35871 3.37028 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 9.34968 8.35871 3.37028 0.154 protocols.relax.FastRelax: {0} CMD: min -15.3001 8.72609 3.61081 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.3001 8.72609 3.61081 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.61193 8.72609 3.61081 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.85545 8.72609 3.61081 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.24527 8.72609 3.61081 0.31955 protocols.relax.FastRelax: {0} CMD: min -13.1268 8.95372 3.82543 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.1268 8.95372 3.82543 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.29262 8.95372 3.82543 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -4.30658 8.95372 3.82543 0.55 protocols.relax.FastRelax: {0} CMD: min -12.7482 8.6998 3.39696 0.55 protocols.relax.FastRelax: {0} MRP: 0 -12.7482 -12.7482 8.6998 3.39696 protocols.relax.FastRelax: {0} CMD: accept_to_best -12.7482 8.6998 3.39696 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -12.7482 8.6998 3.39696 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.7482 8.6998 3.39696 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.5704 8.6998 3.39696 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 639 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.6916 8.6998 3.39696 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.4716 8.6998 3.39696 0.02805 protocols.relax.FastRelax: {0} CMD: min -41.8353 8.86135 3.89538 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.8353 8.86135 3.89538 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.06 8.86135 3.89538 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.098 8.86135 3.89538 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.9349 8.86135 3.89538 0.154 protocols.relax.FastRelax: {0} CMD: min -30.8461 8.87438 3.8525 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.8461 8.87438 3.8525 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.6289 8.87438 3.8525 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 648 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.7523 8.87438 3.8525 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.1083 8.87438 3.8525 0.31955 protocols.relax.FastRelax: {0} CMD: min -22.5791 8.87488 3.84694 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.5791 8.87488 3.84694 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.0486 8.87488 3.84694 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.0898 8.87488 3.84694 0.55 protocols.relax.FastRelax: {0} CMD: min -23.1984 9.127 4.25337 0.55 protocols.relax.FastRelax: {0} MRP: 1 -23.1984 -23.1984 9.127 4.25337 protocols.relax.FastRelax: {0} CMD: accept_to_best -23.1984 9.127 4.25337 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -23.1984 9.127 4.25337 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.1984 9.127 4.25337 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.5211 9.127 4.25337 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.7814 9.127 4.25337 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.5848 9.127 4.25337 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.9588 9.16368 4.30554 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.9588 9.16368 4.30554 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.9334 9.16368 4.30554 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.1471 9.16368 4.30554 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.2513 9.16368 4.30554 0.154 protocols.relax.FastRelax: {0} CMD: min -32.5699 9.11332 4.22561 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.5699 9.11332 4.22561 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.3955 9.11332 4.22561 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.5541 9.11332 4.22561 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.6858 9.11332 4.22561 0.31955 protocols.relax.FastRelax: {0} CMD: min -29.0051 9.16212 4.28898 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.0051 9.16212 4.28898 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.5265 9.16212 4.28898 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.5265 9.16212 4.28898 0.55 protocols.relax.FastRelax: {0} CMD: min -23.4581 9.09814 4.18481 0.55 protocols.relax.FastRelax: {0} MRP: 2 -23.4581 -23.4581 9.09814 4.18481 protocols.relax.FastRelax: {0} CMD: accept_to_best -23.4581 9.09814 4.18481 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -23.4581 9.09814 4.18481 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.4581 9.09814 4.18481 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.8354 9.09814 4.18481 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.9965 9.09814 4.18481 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.8022 9.09814 4.18481 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.2422 9.10433 4.23235 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.2422 9.10433 4.23235 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.6994 9.10433 4.23235 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 622 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.8733 9.10433 4.23235 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.0085 9.10433 4.23235 0.154 protocols.relax.FastRelax: {0} CMD: min -35.6293 9.10176 4.20426 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.6293 9.10176 4.20426 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.6348 9.10176 4.20426 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.6348 9.10176 4.20426 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.0832 9.10176 4.20426 0.31955 protocols.relax.FastRelax: {0} CMD: min -28.4691 9.0884 4.18339 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.4691 9.0884 4.18339 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.6977 9.0884 4.18339 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.7149 9.0884 4.18339 0.55 protocols.relax.FastRelax: {0} CMD: min -23.4585 9.10253 4.19346 0.55 protocols.relax.FastRelax: {0} MRP: 3 -23.4585 -23.4585 9.10253 4.19346 protocols.relax.FastRelax: {0} CMD: accept_to_best -23.4585 9.10253 4.19346 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -23.4585 9.10253 4.19346 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.4585 9.10253 4.19346 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.8406 9.10253 4.19346 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 663 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.0067 9.10253 4.19346 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.8134 9.10253 4.19346 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.5551 9.15293 4.31737 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.5551 9.15293 4.31737 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.4581 9.15293 4.31737 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 623 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.7358 9.15293 4.31737 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5586 9.15293 4.31737 0.154 protocols.relax.FastRelax: {0} CMD: min -35.2989 9.11845 4.25318 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.2989 9.11845 4.25318 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.3696 9.11845 4.25318 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.3702 9.11845 4.25318 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.8239 9.11845 4.25318 0.31955 protocols.relax.FastRelax: {0} CMD: min -28.5723 9.10124 4.21509 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.5723 9.10124 4.21509 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.1961 9.10124 4.21509 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.2175 9.10124 4.21509 0.55 protocols.relax.FastRelax: {0} CMD: min -23.4584 9.10351 4.19637 0.55 protocols.relax.FastRelax: {0} MRP: 4 -23.4584 -23.4585 9.10253 4.19346 protocols.relax.FastRelax: {0} CMD: accept_to_best -23.4584 9.10351 4.19637 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -23.4584 9.10351 4.19637 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_35.pdb protocols.relax.FastRelax: {0} CMD: repeat 13539.9 9.62623 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 13539.9 9.62623 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1863.39 9.62623 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 599 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 81.8249 9.62623 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 83.4944 9.62623 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -13.8993 9.3949 2.38019 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.8993 9.3949 2.38019 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.88003 9.3949 2.38019 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 616 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.600046 9.3949 2.38019 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 0.504724 9.3949 2.38019 0.154 protocols.relax.FastRelax: {0} CMD: min -15.4606 9.58742 2.78825 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.4606 9.58742 2.78825 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.56086 9.58742 2.78825 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 628 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.75458 9.58742 2.78825 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.21358 9.58742 2.78825 0.31955 protocols.relax.FastRelax: {0} CMD: min -8.78135 9.60112 2.77191 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.78135 9.60112 2.77191 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 0.338691 9.60112 2.77191 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.00120395 9.60112 2.77191 0.55 protocols.relax.FastRelax: {0} CMD: min 118.812 11.068 7.16488 0.55 protocols.relax.FastRelax: {0} MRP: 0 118.812 118.812 11.068 7.16488 protocols.relax.FastRelax: {0} CMD: accept_to_best 118.812 11.068 7.16488 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 118.812 11.068 7.16488 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 118.812 11.068 7.16488 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.7613 11.068 7.16488 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 667 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -46.6155 11.068 7.16488 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.0274 11.068 7.16488 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.6134 10.8985 6.88511 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.6134 10.8985 6.88511 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.3302 10.8985 6.88511 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 652 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.6383 10.8985 6.88511 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.9185 10.8985 6.88511 0.154 protocols.relax.FastRelax: {0} CMD: min -44.8688 10.8927 6.87752 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.8688 10.8927 6.87752 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.7906 10.8927 6.87752 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.8073 10.8927 6.87752 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.3294 10.8927 6.87752 0.31955 protocols.relax.FastRelax: {0} CMD: min -38.8022 10.9023 6.89404 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.8022 10.9023 6.89404 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.8442 10.9023 6.89404 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.8445 10.9023 6.89404 0.55 protocols.relax.FastRelax: {0} CMD: min -35.4938 10.5751 6.27734 0.55 protocols.relax.FastRelax: {0} MRP: 1 -35.4938 -35.4938 10.5751 6.27734 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.4938 10.5751 6.27734 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.4938 10.5751 6.27734 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.4938 10.5751 6.27734 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.3234 10.5751 6.27734 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.3894 10.5751 6.27734 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.8791 10.5751 6.27734 0.02805 protocols.relax.FastRelax: {0} CMD: min -53.1098 10.5658 6.08209 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -53.1098 10.5658 6.08209 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.8092 10.5658 6.08209 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 663 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.1751 10.5658 6.08209 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.2353 10.5658 6.08209 0.154 protocols.relax.FastRelax: {0} CMD: min -46.4259 10.5238 6.19911 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.4259 10.5238 6.19911 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.72 10.5238 6.19911 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 649 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.7353 10.5238 6.19911 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.2858 10.5238 6.19911 0.31955 protocols.relax.FastRelax: {0} CMD: min -41.0872 10.5498 6.19021 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.0872 10.5498 6.19021 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.6919 10.5498 6.19021 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 644 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.6928 10.5498 6.19021 0.55 protocols.relax.FastRelax: {0} CMD: min -35.5593 10.5674 6.30016 0.55 protocols.relax.FastRelax: {0} MRP: 2 -35.5593 -35.5593 10.5674 6.30016 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.5593 10.5674 6.30016 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.5593 10.5674 6.30016 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.5593 10.5674 6.30016 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.3606 10.5674 6.30016 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.2222 10.5674 6.30016 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.6704 10.5674 6.30016 0.02805 protocols.relax.FastRelax: {0} CMD: min -53.7502 10.5492 6.09374 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -53.7502 10.5492 6.09374 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.7673 10.5492 6.09374 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.8217 10.5492 6.09374 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.1717 10.5492 6.09374 0.154 protocols.relax.FastRelax: {0} CMD: min -46.3106 10.5543 6.21328 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.3106 10.5543 6.21328 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.1907 10.5543 6.21328 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.1962 10.5543 6.21328 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.7143 10.5543 6.21328 0.31955 protocols.relax.FastRelax: {0} CMD: min -41.1332 10.5497 6.28148 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.1332 10.5497 6.28148 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.8313 10.5497 6.28148 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.8317 10.5497 6.28148 0.55 protocols.relax.FastRelax: {0} CMD: min -35.5595 10.5745 6.31911 0.55 protocols.relax.FastRelax: {0} MRP: 3 -35.5595 -35.5595 10.5745 6.31911 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.5595 10.5745 6.31911 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.5595 10.5745 6.31911 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.5595 10.5745 6.31911 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.3625 10.5745 6.31911 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.2164 10.5745 6.31911 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.6595 10.5745 6.31911 0.02805 protocols.relax.FastRelax: {0} CMD: min -53.0499 10.5901 6.12785 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -53.0499 10.5901 6.12785 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.8501 10.5901 6.12785 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 663 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -43.2823 10.5901 6.12785 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.697 10.5901 6.12785 0.154 protocols.relax.FastRelax: {0} CMD: min -46.2057 10.5455 6.17304 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.2057 10.5455 6.17304 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.1338 10.5455 6.17304 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 650 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.3061 10.5455 6.17304 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.8283 10.5455 6.17304 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.7427 10.5606 6.22291 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.7427 10.5606 6.22291 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.8657 10.5606 6.22291 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 644 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.8662 10.5606 6.22291 0.55 protocols.relax.FastRelax: {0} CMD: min -35.5602 10.5632 6.28665 0.55 protocols.relax.FastRelax: {0} MRP: 4 -35.5602 -35.5602 10.5632 6.28665 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.5602 10.5632 6.28665 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.5602 10.5632 6.28665 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_45.pdb protocols.relax.FastRelax: {0} CMD: repeat 13918.5 8.11928 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 13918.5 8.11928 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2127.69 8.11928 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 151.343 8.11928 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 178.064 8.11928 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -18.1638 8.98494 4.95238 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.1638 8.98494 4.95238 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1.81586 8.98494 4.95238 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -1.46432 8.98494 4.95238 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.369188 8.98494 4.95238 0.154 protocols.relax.FastRelax: {0} CMD: min -15.7821 9.77683 6.59077 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.7821 9.77683 6.59077 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.65762 9.77683 6.59077 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -7.77226 9.77683 6.59077 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.13821 9.77683 6.59077 0.31955 protocols.relax.FastRelax: {0} CMD: min -9.52475 9.73084 6.44924 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.52475 9.73084 6.44924 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.07082 9.73084 6.44924 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 626 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.07581 9.73084 6.44924 0.55 protocols.relax.FastRelax: {0} CMD: min -7.09474 9.75492 6.28819 0.55 protocols.relax.FastRelax: {0} MRP: 0 -7.09474 -7.09474 9.75492 6.28819 protocols.relax.FastRelax: {0} CMD: accept_to_best -7.09474 9.75492 6.28819 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -7.09474 9.75492 6.28819 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -7.09474 9.75492 6.28819 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.1693 9.75492 6.28819 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 685 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.8904 9.75492 6.28819 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.0102 9.75492 6.28819 0.02805 protocols.relax.FastRelax: {0} CMD: min -28.024 9.77826 6.41136 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.024 9.77826 6.41136 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.79459 9.77826 6.41136 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.9354 9.77826 6.41136 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.9622 9.77826 6.41136 0.154 protocols.relax.FastRelax: {0} CMD: min -18.7397 9.7586 6.46734 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.7397 9.7586 6.46734 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.1207 9.7586 6.46734 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.1386 9.7586 6.46734 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.6185 9.7586 6.46734 0.31955 protocols.relax.FastRelax: {0} CMD: min -13.8081 9.7665 6.49043 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.8081 9.7665 6.49043 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.83243 9.7665 6.49043 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 626 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.5101 9.7665 6.49043 0.55 protocols.relax.FastRelax: {0} CMD: min -8.82718 9.90014 6.7098 0.55 protocols.relax.FastRelax: {0} MRP: 1 -8.82718 -8.82718 9.90014 6.7098 protocols.relax.FastRelax: {0} CMD: accept_to_best -8.82718 9.90014 6.7098 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -8.82718 9.90014 6.7098 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.82718 9.90014 6.7098 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.4831 9.90014 6.7098 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 697 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.1701 9.90014 6.7098 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.9853 9.90014 6.7098 0.02805 protocols.relax.FastRelax: {0} CMD: min -21.1267 9.89559 6.70774 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.1267 9.89559 6.70774 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.4955 9.89559 6.70774 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.979 9.89559 6.70774 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.7869 9.89559 6.70774 0.154 protocols.relax.FastRelax: {0} CMD: min -17.8512 9.89224 6.70618 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.8512 9.89224 6.70618 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.2485 9.89224 6.70618 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 628 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.2485 9.89224 6.70618 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.9644 9.89224 6.70618 0.31955 protocols.relax.FastRelax: {0} CMD: min -13.98 9.8904 6.70512 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.98 9.8904 6.70512 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.5558 9.8904 6.70512 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.55582 9.8904 6.70512 0.55 protocols.relax.FastRelax: {0} CMD: min -9.3841 9.87993 6.71012 0.55 protocols.relax.FastRelax: {0} MRP: 2 -9.3841 -9.3841 9.87993 6.71012 protocols.relax.FastRelax: {0} CMD: accept_to_best -9.3841 9.87993 6.71012 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -9.3841 9.87993 6.71012 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.3841 9.87993 6.71012 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.2042 9.87993 6.71012 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 704 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.8469 9.87993 6.71012 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.9379 9.87993 6.71012 0.02805 protocols.relax.FastRelax: {0} CMD: min -21.0722 9.87638 6.7085 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.0722 9.87638 6.7085 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.34878 9.87638 6.7085 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.5956 9.87638 6.7085 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.401 9.87638 6.7085 0.154 protocols.relax.FastRelax: {0} CMD: min -18.4629 9.87398 6.70746 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.4629 9.87398 6.70746 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.8129 9.87398 6.70746 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.8129 9.87398 6.70746 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.5251 9.87398 6.70746 0.31955 protocols.relax.FastRelax: {0} CMD: min -14.5355 9.87332 6.70723 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.5355 9.87332 6.70723 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.03567 9.87332 6.70723 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 624 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.03571 9.87332 6.70723 0.55 protocols.relax.FastRelax: {0} CMD: min -9.38267 9.88602 6.72081 0.55 protocols.relax.FastRelax: {0} MRP: 3 -9.38267 -9.3841 9.87993 6.71012 protocols.relax.FastRelax: {0} CMD: accept_to_best -9.38267 9.88602 6.72081 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -9.38267 9.88602 6.72081 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.38267 9.88602 6.72081 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.2015 9.88602 6.72081 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.8608 9.88602 6.72081 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.6737 9.88602 6.72081 0.02805 protocols.relax.FastRelax: {0} CMD: min -21.8117 9.88217 6.71897 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.8117 9.88217 6.71897 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.1373 9.88217 6.71897 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.6067 9.88217 6.71897 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.4122 9.88217 6.71897 0.154 protocols.relax.FastRelax: {0} CMD: min -18.474 9.87983 6.71796 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.474 9.87983 6.71796 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.8262 9.87983 6.71796 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.8262 9.87983 6.71796 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.5385 9.87983 6.71796 0.31955 protocols.relax.FastRelax: {0} CMD: min -14.5489 9.87923 6.71778 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.5489 9.87923 6.71778 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.05251 9.87923 6.71778 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 624 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.05255 9.87923 6.71778 0.55 protocols.relax.FastRelax: {0} CMD: min -9.38289 9.88921 6.72529 0.55 protocols.relax.FastRelax: {0} MRP: 4 -9.38289 -9.3841 9.87993 6.71012 protocols.relax.FastRelax: {0} CMD: accept_to_best -9.38289 9.88921 6.72529 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -9.38289 9.88921 6.72529 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_23.pdb protocols.relax.FastRelax: {0} CMD: repeat 14018.3 8.56048 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14018.3 8.56048 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1905.06 8.56048 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 578 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 82.2227 8.56048 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 85.6858 8.56048 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 52.6155 8.86319 2.62931 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 52.6155 8.86319 2.62931 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 103.461 8.86319 2.62931 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 568 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 64.9831 8.86319 2.62931 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 66.2384 8.86319 2.62931 0.154 protocols.relax.FastRelax: {0} CMD: min -13.5058 8.34284 3.7602 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.5058 8.34284 3.7602 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.01322 8.34284 3.7602 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 607 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -6.94757 8.34284 3.7602 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.34746 8.34284 3.7602 0.31955 protocols.relax.FastRelax: {0} CMD: min -6.62202 8.32968 3.74547 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -6.62202 8.32968 3.74547 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.23025 8.32968 3.74547 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 601 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 3.97188 8.32968 3.74547 0.55 protocols.relax.FastRelax: {0} CMD: min -10.4292 8.66524 4.76921 0.55 protocols.relax.FastRelax: {0} MRP: 0 -10.4292 -10.4292 8.66524 4.76921 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.4292 8.66524 4.76921 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.4292 8.66524 4.76921 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.4292 8.66524 4.76921 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.9525 8.66524 4.76921 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.2601 8.66524 4.76921 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0739 8.66524 4.76921 0.02805 protocols.relax.FastRelax: {0} CMD: min -25.9461 8.70747 4.83746 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.9461 8.70747 4.83746 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7368 8.70747 4.83746 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 640 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.1466 8.70747 4.83746 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.8199 8.70747 4.83746 0.154 protocols.relax.FastRelax: {0} CMD: min -21.4711 8.68111 4.7979 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.4711 8.68111 4.7979 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7912 8.68111 4.7979 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7913 8.68111 4.7979 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.4222 8.68111 4.7979 0.31955 protocols.relax.FastRelax: {0} CMD: min -16.592 8.67098 4.78396 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.592 8.67098 4.78396 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.1073 8.67098 4.78396 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.1073 8.67098 4.78396 0.55 protocols.relax.FastRelax: {0} CMD: min -13.4756 8.39315 5.01646 0.55 protocols.relax.FastRelax: {0} MRP: 1 -13.4756 -13.4756 8.39315 5.01646 protocols.relax.FastRelax: {0} CMD: accept_to_best -13.4756 8.39315 5.01646 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -13.4756 8.39315 5.01646 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.4756 8.39315 5.01646 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.1733 8.39315 5.01646 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.2591 8.39315 5.01646 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.0997 8.39315 5.01646 0.02805 protocols.relax.FastRelax: {0} CMD: min -28.6752 8.43734 5.06771 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.6752 8.43734 5.06771 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.4156 8.43734 5.06771 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.4156 8.43734 5.06771 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.117 8.43734 5.06771 0.154 protocols.relax.FastRelax: {0} CMD: min -24.5508 8.41957 5.04322 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.5508 8.41957 5.04322 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.8155 8.41957 5.04322 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 628 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.8155 8.41957 5.04322 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.4421 8.41957 5.04322 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.6718 8.40538 5.02619 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.6718 8.40538 5.02619 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.1565 8.40538 5.02619 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 618 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.1565 8.40538 5.02619 0.55 protocols.relax.FastRelax: {0} CMD: min -13.5002 8.39752 5.1232 0.55 protocols.relax.FastRelax: {0} MRP: 2 -13.5002 -13.5002 8.39752 5.1232 protocols.relax.FastRelax: {0} CMD: accept_to_best -13.5002 8.39752 5.1232 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -13.5002 8.39752 5.1232 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.5002 8.39752 5.1232 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.1097 8.39752 5.1232 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1885 8.39752 5.1232 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.0304 8.39752 5.1232 0.02805 protocols.relax.FastRelax: {0} CMD: min -28.5722 8.4464 5.17846 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.5722 8.4464 5.17846 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3264 8.4464 5.17846 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.3264 8.4464 5.17846 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0288 8.4464 5.17846 0.154 protocols.relax.FastRelax: {0} CMD: min -24.4877 8.42614 5.15065 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.4877 8.42614 5.15065 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.7972 8.42614 5.15065 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.7972 8.42614 5.15065 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.4274 8.42614 5.15065 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.6555 8.41089 5.13303 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.6555 8.41089 5.13303 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.2004 8.41089 5.13303 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 619 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.2005 8.41089 5.13303 0.55 protocols.relax.FastRelax: {0} CMD: min -13.5054 8.39939 5.12699 0.55 protocols.relax.FastRelax: {0} MRP: 3 -13.5054 -13.5054 8.39939 5.12699 protocols.relax.FastRelax: {0} CMD: accept_to_best -13.5054 8.39939 5.12699 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -13.5054 8.39939 5.12699 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.5054 8.39939 5.12699 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.1086 8.39939 5.12699 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1894 8.39939 5.12699 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.0281 8.39939 5.12699 0.02805 protocols.relax.FastRelax: {0} CMD: min -28.5493 8.44868 5.18428 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.5493 8.44868 5.18428 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.2382 8.44868 5.18428 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.2382 8.44868 5.18428 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.936 8.44868 5.18428 0.154 protocols.relax.FastRelax: {0} CMD: min -24.4038 8.42768 5.15528 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.4038 8.42768 5.15528 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.6342 8.42768 5.15528 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.6342 8.42768 5.15528 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.2581 8.42768 5.15528 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.4902 8.41211 5.13752 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.4902 8.41211 5.13752 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.9214 8.41211 5.13752 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 619 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.9214 8.41211 5.13752 0.55 protocols.relax.FastRelax: {0} CMD: min -13.5194 8.42818 5.15742 0.55 protocols.relax.FastRelax: {0} MRP: 4 -13.5194 -13.5194 8.42818 5.15742 protocols.relax.FastRelax: {0} CMD: accept_to_best -13.5194 8.42818 5.15742 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -13.5194 8.42818 5.15742 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_21.pdb protocols.relax.FastRelax: {0} CMD: repeat 13694.2 7.86898 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 13694.2 7.86898 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1845.27 7.86898 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 43.958 7.86898 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 45.9725 7.86898 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -23.9542 7.8224 7.42572 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.9542 7.8224 7.42572 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.32111 7.8224 7.42572 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.3498 7.8224 7.42572 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.414 7.8224 7.42572 0.154 protocols.relax.FastRelax: {0} CMD: min -10.4968 7.82524 7.42583 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.4968 7.82524 7.42583 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 6.81584 7.82524 7.42583 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 6.25147 7.82524 7.42583 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 7.50286 7.82524 7.42583 0.31955 protocols.relax.FastRelax: {0} CMD: min -16.2076 7.9851 8.31851 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.2076 7.9851 8.31851 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.43894 7.9851 8.31851 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 622 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.43897 7.9851 8.31851 0.55 protocols.relax.FastRelax: {0} CMD: min -16.6888 8.29313 9.6511 0.55 protocols.relax.FastRelax: {0} MRP: 0 -16.6888 -16.6888 8.29313 9.6511 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.6888 8.29313 9.6511 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.6888 8.29313 9.6511 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.6888 8.29313 9.6511 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.1285 8.29313 9.6511 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 660 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.995 8.29313 9.6511 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.7848 8.29313 9.6511 0.02805 protocols.relax.FastRelax: {0} CMD: min -32.798 8.29207 9.65109 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.798 8.29207 9.65109 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.7051 8.29207 9.65109 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 626 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.3104 8.29207 9.65109 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.074 8.29207 9.65109 0.154 protocols.relax.FastRelax: {0} CMD: min -29.0823 8.29123 9.65096 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.0823 8.29123 9.65096 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.6821 8.29123 9.65096 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 613 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.6821 8.29123 9.65096 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3351 8.29123 9.65096 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.3381 8.29078 9.65092 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.3381 8.29078 9.65092 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.7273 8.29078 9.65092 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 611 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.6825 8.29078 9.65092 0.55 protocols.relax.FastRelax: {0} CMD: min -19.2891 8.4393 9.93 0.55 protocols.relax.FastRelax: {0} MRP: 1 -19.2891 -19.2891 8.4393 9.93 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.2891 8.4393 9.93 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.2891 8.4393 9.93 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.2891 8.4393 9.93 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.7729 8.4393 9.93 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.3071 8.4393 9.93 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.1063 8.4393 9.93 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.1199 8.43831 9.93001 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.1199 8.43831 9.93001 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.2101 8.43831 9.93001 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.5491 8.43831 9.93001 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.3152 8.43831 9.93001 0.154 protocols.relax.FastRelax: {0} CMD: min -30.3228 8.4375 9.92989 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3228 8.4375 9.92989 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9697 8.4375 9.92989 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9697 8.4375 9.92989 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.6265 8.4375 9.92989 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.6287 8.43706 9.9298 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.6287 8.43706 9.9298 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.0889 8.43706 9.9298 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.0889 8.43706 9.9298 0.55 protocols.relax.FastRelax: {0} CMD: min -19.2912 8.44051 9.93445 0.55 protocols.relax.FastRelax: {0} MRP: 2 -19.2912 -19.2912 8.44051 9.93445 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.2912 8.44051 9.93445 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.2912 8.44051 9.93445 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.2912 8.44051 9.93445 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.7635 8.44051 9.93445 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.3136 8.44051 9.93445 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.1114 8.44051 9.93445 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.125 8.43952 9.93447 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.125 8.43952 9.93447 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.1888 8.43952 9.93447 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.5416 8.43952 9.93447 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.308 8.43952 9.93447 0.154 protocols.relax.FastRelax: {0} CMD: min -30.3156 8.43872 9.93434 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3156 8.43872 9.93434 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9668 8.43872 9.93434 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9668 8.43872 9.93434 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.6239 8.43872 9.93434 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.6262 8.43828 9.93425 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.6262 8.43828 9.93425 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.0928 8.43828 9.93425 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 609 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.0928 8.43828 9.93425 0.55 protocols.relax.FastRelax: {0} CMD: min -19.2915 8.43932 9.93343 0.55 protocols.relax.FastRelax: {0} MRP: 3 -19.2915 -19.2915 8.43932 9.93343 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.2915 8.43932 9.93343 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.2915 8.43932 9.93343 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.2915 8.43932 9.93343 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.7693 8.43932 9.93343 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.3154 8.43932 9.93343 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.1139 8.43932 9.93343 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.1275 8.43833 9.93346 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.1275 8.43833 9.93346 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.2034 8.43833 9.93346 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.5441 8.43833 9.93346 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.3105 8.43833 9.93346 0.154 protocols.relax.FastRelax: {0} CMD: min -30.3181 8.43754 9.93334 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3181 8.43754 9.93334 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9687 8.43754 9.93334 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9687 8.43754 9.93334 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.6258 8.43754 9.93334 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.628 8.4371 9.93325 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.628 8.4371 9.93325 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.0937 8.4371 9.93325 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.0937 8.4371 9.93325 0.55 protocols.relax.FastRelax: {0} CMD: min -19.2917 8.43976 9.93251 0.55 protocols.relax.FastRelax: {0} MRP: 4 -19.2917 -19.2917 8.43976 9.93251 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.2917 8.43976 9.93251 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.2917 8.43976 9.93251 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_10.pdb protocols.relax.FastRelax: {0} CMD: repeat 16894.3 5.5865 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16894.3 5.5865 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2266.27 5.5865 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 199.111 5.5865 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 241.355 5.5865 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 78.2382 15.2826 16.1363 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 78.2382 15.2826 16.1363 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 121.729 15.2826 16.1363 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 644 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 91.2131 15.2826 16.1363 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 92.9818 15.2826 16.1363 0.154 protocols.relax.FastRelax: {0} CMD: min -19.0217 11.7383 12.2778 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.0217 11.7383 12.2778 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.4563 11.7383 12.2778 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.9892 11.7383 12.2778 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.479 11.7383 12.2778 0.31955 protocols.relax.FastRelax: {0} CMD: min -13.5342 11.743 12.2836 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.5342 11.743 12.2836 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.88236 11.743 12.2836 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -3.88237 11.743 12.2836 0.55 protocols.relax.FastRelax: {0} CMD: min -18.9195 13.4113 13.6826 0.55 protocols.relax.FastRelax: {0} MRP: 0 -18.9195 -18.9195 13.4113 13.6826 protocols.relax.FastRelax: {0} CMD: accept_to_best -18.9195 13.4113 13.6826 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -18.9195 13.4113 13.6826 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.9195 13.4113 13.6826 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.9553 13.4113 13.6826 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.1691 13.4113 13.6826 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.0023 13.4113 13.6826 0.02805 protocols.relax.FastRelax: {0} CMD: min -32.0177 13.4081 13.6791 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.0177 13.4081 13.6791 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.7688 13.4081 13.6791 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.7995 13.4081 13.6791 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.5746 13.4081 13.6791 0.154 protocols.relax.FastRelax: {0} CMD: min -28.5834 13.4067 13.6774 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.5834 13.4067 13.6774 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3976 13.4067 13.6774 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.6045 13.4067 13.6774 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3228 13.4067 13.6774 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.3279 13.4065 13.6771 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.3279 13.4065 13.6771 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.9628 13.4065 13.6771 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.9629 13.4065 13.6771 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2692 13.5739 13.8921 0.55 protocols.relax.FastRelax: {0} MRP: 1 -21.2692 -21.2692 13.5739 13.8921 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2692 13.5739 13.8921 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2692 13.5739 13.8921 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2692 13.5739 13.8921 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.5684 13.5739 13.8921 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.7274 13.5739 13.8921 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4584 13.5739 13.8921 0.02805 protocols.relax.FastRelax: {0} CMD: min -33.4758 13.5708 13.8885 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4758 13.5708 13.8885 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2469 13.5708 13.8885 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.8339 13.5708 13.8885 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.6061 13.5708 13.8885 0.154 protocols.relax.FastRelax: {0} CMD: min -29.6147 13.5693 13.8867 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.6147 13.5693 13.8867 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.3757 13.5693 13.8867 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.574 13.5693 13.8867 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2879 13.5693 13.8867 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.293 13.569 13.8864 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.293 13.569 13.8864 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.8445 13.569 13.8864 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.8445 13.569 13.8864 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2622 13.5817 13.8998 0.55 protocols.relax.FastRelax: {0} MRP: 2 -21.2622 -21.2692 13.5739 13.8921 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2622 13.5817 13.8998 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2622 13.5817 13.8998 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2622 13.5817 13.8998 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.5243 13.5817 13.8998 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.671 13.5817 13.8998 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4045 13.5817 13.8998 0.02805 protocols.relax.FastRelax: {0} CMD: min -33.4218 13.5786 13.8962 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4218 13.5786 13.8962 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2405 13.5786 13.8962 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.8122 13.5786 13.8962 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.5852 13.5786 13.8962 0.154 protocols.relax.FastRelax: {0} CMD: min -29.5938 13.577 13.8944 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.5938 13.577 13.8944 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.3682 13.577 13.8944 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.577 13.577 13.8944 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2922 13.577 13.8944 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.2972 13.5767 13.894 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.2972 13.5767 13.894 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.8725 13.5767 13.894 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 667 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.8725 13.5767 13.894 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2653 13.5864 13.9055 0.55 protocols.relax.FastRelax: {0} MRP: 3 -21.2653 -21.2692 13.5739 13.8921 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2653 13.5864 13.9055 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2653 13.5864 13.9055 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2653 13.5864 13.9055 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.5528 13.5864 13.9055 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.6983 13.5864 13.9055 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4289 13.5864 13.9055 0.02805 protocols.relax.FastRelax: {0} CMD: min -33.4464 13.5832 13.9019 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4464 13.5832 13.9019 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2106 13.5832 13.9019 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.8302 13.5832 13.9019 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.603 13.5832 13.9019 0.154 protocols.relax.FastRelax: {0} CMD: min -29.6117 13.5817 13.9001 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.6117 13.5817 13.9001 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.3837 13.5817 13.9001 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.5723 13.5817 13.9001 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.287 13.5817 13.9001 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.292 13.5813 13.8996 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.292 13.5813 13.8996 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.8572 13.5813 13.8996 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 667 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.8572 13.5813 13.8996 0.55 protocols.relax.FastRelax: {0} CMD: min -21.2652 13.5857 13.9048 0.55 protocols.relax.FastRelax: {0} MRP: 4 -21.2652 -21.2692 13.5739 13.8921 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.2652 13.5857 13.9048 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.2652 13.5857 13.9048 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_18.pdb protocols.relax.FastRelax: {0} CMD: repeat 17833.1 7.82024 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 17833.1 7.82024 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1902.09 7.82024 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 144.74 7.82024 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 175.508 7.82024 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -16.6469 8.61471 5.08345 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.6469 8.61471 5.08345 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 7.3725 8.61471 5.08345 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 0.978489 8.61471 5.08345 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.34424 8.61471 5.08345 0.154 protocols.relax.FastRelax: {0} CMD: min -27.2415 9.12336 4.62706 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.2415 9.12336 4.62706 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.0438 9.12336 4.62706 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.1461 9.12336 4.62706 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.3441 9.12336 4.62706 0.31955 protocols.relax.FastRelax: {0} CMD: min -16.7682 9.09257 4.58815 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.7682 9.09257 4.58815 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.38368 9.09257 4.58815 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.47037 9.09257 4.58815 0.55 protocols.relax.FastRelax: {0} CMD: min -15.7696 9.51572 4.70689 0.55 protocols.relax.FastRelax: {0} MRP: 0 -15.7696 -15.7696 9.51572 4.70689 protocols.relax.FastRelax: {0} CMD: accept_to_best -15.7696 9.51572 4.70689 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -15.7696 9.51572 4.70689 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.7696 9.51572 4.70689 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.5918 9.51572 4.70689 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.759 9.51572 4.70689 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.1737 9.51572 4.70689 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.2356 9.31895 4.56762 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.2356 9.31895 4.56762 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.8165 9.31895 4.56762 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.263 9.31895 4.56762 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.6988 9.31895 4.56762 0.154 protocols.relax.FastRelax: {0} CMD: min -32.0656 9.38597 4.59632 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.0656 9.38597 4.59632 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.007 9.38597 4.59632 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 639 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.1952 9.38597 4.59632 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.4917 9.38597 4.59632 0.31955 protocols.relax.FastRelax: {0} CMD: min -23.3243 9.36452 4.57033 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.3243 9.36452 4.57033 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.562 9.36452 4.57033 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.625 9.36452 4.57033 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6857 9.5085 4.59243 0.55 protocols.relax.FastRelax: {0} MRP: 1 -17.6857 -17.6857 9.5085 4.59243 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6857 9.5085 4.59243 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6857 9.5085 4.59243 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6857 9.5085 4.59243 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5707 9.5085 4.59243 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 663 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.6177 9.5085 4.59243 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.4204 9.5085 4.59243 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.6169 9.42635 4.56995 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.6169 9.42635 4.56995 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0316 9.42635 4.56995 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.095 9.42635 4.56995 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.7977 9.42635 4.56995 0.154 protocols.relax.FastRelax: {0} CMD: min -33.3841 9.39565 4.54283 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.3841 9.39565 4.54283 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.9279 9.39565 4.54283 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 639 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.9361 9.39565 4.54283 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.2693 9.39565 4.54283 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.8643 9.36656 4.50247 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.8643 9.36656 4.50247 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.4266 9.36656 4.50247 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.4779 9.36656 4.50247 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6754 9.503 4.58916 0.55 protocols.relax.FastRelax: {0} MRP: 2 -17.6754 -17.6857 9.5085 4.59243 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6754 9.503 4.58916 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6754 9.503 4.58916 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6754 9.503 4.58916 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5585 9.503 4.58916 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.611 9.503 4.58916 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.4138 9.503 4.58916 0.02805 protocols.relax.FastRelax: {0} CMD: min -41.1786 9.58898 4.7144 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.1786 9.58898 4.7144 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.0824 9.58898 4.7144 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.1378 9.58898 4.7144 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.8735 9.58898 4.7144 0.154 protocols.relax.FastRelax: {0} CMD: min -33.092 9.45422 4.57562 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.092 9.45422 4.57562 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2781 9.45422 4.57562 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 640 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.2781 9.45422 4.57562 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.6619 9.45422 4.57562 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.1398 9.4291 4.54135 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.1398 9.4291 4.54135 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.4186 9.4291 4.54135 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.4231 9.4291 4.54135 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6925 9.50904 4.59644 0.55 protocols.relax.FastRelax: {0} MRP: 3 -17.6925 -17.6925 9.50904 4.59644 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6925 9.50904 4.59644 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6925 9.50904 4.59644 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6925 9.50904 4.59644 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5262 9.50904 4.59644 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.5673 9.50904 4.59644 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.3707 9.50904 4.59644 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.4099 9.20639 4.41628 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.4099 9.20639 4.41628 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.889 9.20639 4.41628 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 673 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.0961 9.20639 4.41628 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.6132 9.20639 4.41628 0.154 protocols.relax.FastRelax: {0} CMD: min -33.333 9.36888 4.5142 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.333 9.36888 4.5142 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.7334 9.36888 4.5142 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.7449 9.36888 4.5142 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.9879 9.36888 4.5142 0.31955 protocols.relax.FastRelax: {0} CMD: min -23.6389 9.33452 4.46748 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.6389 9.33452 4.46748 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.5878 9.33452 4.46748 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.613 9.33452 4.46748 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6848 9.50617 4.5981 0.55 protocols.relax.FastRelax: {0} MRP: 4 -17.6848 -17.6925 9.50904 4.59644 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6848 9.50617 4.5981 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6848 9.50617 4.5981 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_6.pdb protocols.relax.FastRelax: {0} CMD: repeat 15996.5 9.08306 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15996.5 9.08306 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1945.91 9.08306 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 89.2574 9.08306 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 101.045 9.08306 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -25.7305 8.34076 3.4874 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.7305 8.34076 3.4874 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.92024 8.34076 3.4874 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.9663 8.34076 3.4874 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.9441 8.34076 3.4874 0.154 protocols.relax.FastRelax: {0} CMD: min -30.1132 8.29649 3.54555 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.1132 8.29649 3.54555 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.2517 8.29649 3.54555 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 641 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.5353 8.29649 3.54555 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.0091 8.29649 3.54555 0.31955 protocols.relax.FastRelax: {0} CMD: min -23.1774 8.27393 3.55134 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.1774 8.27393 3.55134 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.6734 8.27393 3.55134 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.8386 8.27393 3.55134 0.55 protocols.relax.FastRelax: {0} CMD: min -26.4461 7.84773 4.13101 0.55 protocols.relax.FastRelax: {0} MRP: 0 -26.4461 -26.4461 7.84773 4.13101 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.4461 7.84773 4.13101 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.4461 7.84773 4.13101 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.4461 7.84773 4.13101 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.5695 7.84773 4.13101 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 730 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.4929 7.84773 4.13101 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.2936 7.84773 4.13101 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.1215 7.84088 4.17594 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.1215 7.84088 4.17594 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.9744 7.84088 4.17594 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.1763 7.84088 4.17594 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.852 7.84088 4.17594 0.154 protocols.relax.FastRelax: {0} CMD: min -38.3335 7.86339 4.09729 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.3335 7.86339 4.09729 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.2432 7.86339 4.09729 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 681 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.258 7.86339 4.09729 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.8568 7.86339 4.09729 0.31955 protocols.relax.FastRelax: {0} CMD: min -32.9687 7.86201 4.07933 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.9687 7.86201 4.07933 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.574 7.86201 4.07933 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 674 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.574 7.86201 4.07933 0.55 protocols.relax.FastRelax: {0} CMD: min -28.2592 7.81359 4.00145 0.55 protocols.relax.FastRelax: {0} MRP: 1 -28.2592 -28.2592 7.81359 4.00145 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.2592 7.81359 4.00145 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.2592 7.81359 4.00145 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.2592 7.81359 4.00145 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.2758 7.81359 4.00145 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 706 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.7512 7.81359 4.00145 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.5762 7.81359 4.00145 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.5633 7.81204 4.04698 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.5633 7.81204 4.04698 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.8443 7.81204 4.04698 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 694 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.8619 7.81204 4.04698 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.5364 7.81204 4.04698 0.154 protocols.relax.FastRelax: {0} CMD: min -39.8434 7.84759 3.94193 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.8434 7.84759 3.94193 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5209 7.84759 3.94193 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.527 7.84759 3.94193 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.1084 7.84759 3.94193 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.2115 7.8313 3.94297 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.2115 7.8313 3.94297 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.6727 7.8313 3.94297 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.6792 7.8313 3.94297 0.55 protocols.relax.FastRelax: {0} CMD: min -28.2609 7.8094 3.99007 0.55 protocols.relax.FastRelax: {0} MRP: 2 -28.2609 -28.2609 7.8094 3.99007 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.2609 7.8094 3.99007 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.2609 7.8094 3.99007 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.2609 7.8094 3.99007 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.2641 7.8094 3.99007 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 706 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.747 7.8094 3.99007 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.5725 7.8094 3.99007 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.5504 7.79759 4.04881 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.5504 7.79759 4.04881 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.7005 7.79759 4.04881 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 694 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.755 7.79759 4.04881 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.421 7.79759 4.04881 0.154 protocols.relax.FastRelax: {0} CMD: min -39.1284 7.83335 3.99388 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.1284 7.83335 3.99388 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.7303 7.83335 3.99388 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 669 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.7303 7.83335 3.99388 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.3046 7.83335 3.99388 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.1225 7.8344 3.95332 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.1225 7.8344 3.95332 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.326 7.8344 3.95332 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 657 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.3261 7.8344 3.95332 0.55 protocols.relax.FastRelax: {0} CMD: min -28.2685 7.80349 3.97957 0.55 protocols.relax.FastRelax: {0} MRP: 3 -28.2685 -28.2685 7.80349 3.97957 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.2685 7.80349 3.97957 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.2685 7.80349 3.97957 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.2685 7.80349 3.97957 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.2539 7.80349 3.97957 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 705 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.7457 7.80349 3.97957 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.5712 7.80349 3.97957 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.4174 7.77185 4.06856 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.4174 7.77185 4.06856 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.4377 7.77185 4.06856 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 693 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.585 7.77185 4.06856 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.2456 7.77185 4.06856 0.154 protocols.relax.FastRelax: {0} CMD: min -38.8891 7.82021 3.97664 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.8891 7.82021 3.97664 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.5796 7.82021 3.97664 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.5796 7.82021 3.97664 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.1609 7.82021 3.97664 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.8841 7.81615 3.96932 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.8841 7.81615 3.96932 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.8161 7.81615 3.96932 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.8167 7.81615 3.96932 0.55 protocols.relax.FastRelax: {0} CMD: min -28.2311 7.82297 3.9727 0.55 protocols.relax.FastRelax: {0} MRP: 4 -28.2311 -28.2685 7.80349 3.97957 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.2311 7.82297 3.9727 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.2311 7.82297 3.9727 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_27.pdb protocols.relax.FastRelax: {0} CMD: repeat 18966.5 6.50103 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 18966.5 6.50103 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2102.4 6.50103 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 543 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 53.0542 6.50103 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 56.5316 6.50103 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -40.8983 8.27865 6.17198 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.8983 8.27865 6.17198 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.85711 8.27865 6.17198 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 752 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.6636 8.27865 6.17198 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.0434 8.27865 6.17198 0.154 protocols.relax.FastRelax: {0} CMD: min -41.7067 8.69942 7.00564 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.7067 8.69942 7.00564 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.7175 8.69942 7.00564 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 703 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.8326 8.69942 7.00564 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.1258 8.69942 7.00564 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.2255 8.75749 7.04603 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.2255 8.75749 7.04603 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.0993 8.75749 7.04603 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.2419 8.75749 7.04603 0.55 protocols.relax.FastRelax: {0} CMD: min -45.2589 8.98207 7.68865 0.55 protocols.relax.FastRelax: {0} MRP: 0 -45.2589 -45.2589 8.98207 7.68865 protocols.relax.FastRelax: {0} CMD: accept_to_best -45.2589 8.98207 7.68865 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -45.2589 8.98207 7.68865 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.2589 8.98207 7.68865 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -60.4809 8.98207 7.68865 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -65.8128 8.98207 7.68865 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -65.6064 8.98207 7.68865 0.02805 protocols.relax.FastRelax: {0} CMD: min -67.9759 9.12051 7.87602 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -67.9759 9.12051 7.87602 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -61.0934 9.12051 7.87602 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 689 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -61.3354 9.12051 7.87602 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -60.8702 9.12051 7.87602 0.154 protocols.relax.FastRelax: {0} CMD: min -63.2621 8.97982 7.76104 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -63.2621 8.97982 7.76104 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -55.9327 8.97982 7.76104 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -55.9504 8.97982 7.76104 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -55.3739 8.97982 7.76104 0.31955 protocols.relax.FastRelax: {0} CMD: min -57.1332 8.97378 7.709 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -57.1332 8.97378 7.709 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.6276 8.97378 7.709 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 674 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.6503 8.97378 7.709 0.55 protocols.relax.FastRelax: {0} CMD: min -52.7393 8.83739 7.46887 0.55 protocols.relax.FastRelax: {0} MRP: 1 -52.7393 -52.7393 8.83739 7.46887 protocols.relax.FastRelax: {0} CMD: accept_to_best -52.7393 8.83739 7.46887 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -52.7393 8.83739 7.46887 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.7393 8.83739 7.46887 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -68.1478 8.83739 7.46887 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 670 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -68.3609 8.83739 7.46887 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -68.1781 8.83739 7.46887 0.02805 protocols.relax.FastRelax: {0} CMD: min -70.294 8.9675 7.65007 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -70.294 8.9675 7.65007 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -63.9718 8.9675 7.65007 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -64.1775 8.9675 7.65007 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -63.7521 8.9675 7.65007 0.154 protocols.relax.FastRelax: {0} CMD: min -65.8448 8.88686 7.59145 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -65.8448 8.88686 7.59145 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -59.2249 8.88686 7.59145 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 623 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -58.9422 8.88686 7.59145 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -58.3825 8.88686 7.59145 0.31955 protocols.relax.FastRelax: {0} CMD: min -59.2653 8.87436 7.53095 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -59.2653 8.87436 7.53095 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -50.6587 8.87436 7.53095 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 616 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.6717 8.87436 7.53095 0.55 protocols.relax.FastRelax: {0} CMD: min -53.0631 8.84247 7.47571 0.55 protocols.relax.FastRelax: {0} MRP: 2 -53.0631 -53.0631 8.84247 7.47571 protocols.relax.FastRelax: {0} CMD: accept_to_best -53.0631 8.84247 7.47571 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -53.0631 8.84247 7.47571 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -53.0631 8.84247 7.47571 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -68.6422 8.84247 7.47571 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -69.0788 8.84247 7.47571 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -68.8749 8.84247 7.47571 0.02805 protocols.relax.FastRelax: {0} CMD: min -71.0286 8.96031 7.64303 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -71.0286 8.96031 7.64303 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -64.4804 8.96031 7.64303 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 640 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -64.7856 8.96031 7.64303 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -64.341 8.96031 7.64303 0.154 protocols.relax.FastRelax: {0} CMD: min -66.2382 8.88408 7.58073 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -66.2382 8.88408 7.58073 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -59.1679 8.88408 7.58073 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 622 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -59.1679 8.88408 7.58073 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -58.6104 8.88408 7.58073 0.31955 protocols.relax.FastRelax: {0} CMD: min -59.7157 8.86447 7.52836 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -59.7157 8.86447 7.52836 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -51.2054 8.86447 7.52836 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 617 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -51.2321 8.86447 7.52836 0.55 protocols.relax.FastRelax: {0} CMD: min -53.1417 8.83258 7.46191 0.55 protocols.relax.FastRelax: {0} MRP: 3 -53.1417 -53.1417 8.83258 7.46191 protocols.relax.FastRelax: {0} CMD: accept_to_best -53.1417 8.83258 7.46191 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -53.1417 8.83258 7.46191 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -53.1417 8.83258 7.46191 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -68.7023 8.83258 7.46191 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -69.0133 8.83258 7.46191 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -68.8139 8.83258 7.46191 0.02805 protocols.relax.FastRelax: {0} CMD: min -71.0947 8.95477 7.6352 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -71.0947 8.95477 7.6352 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -64.3784 8.95477 7.6352 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 640 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -64.6656 8.95477 7.6352 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -64.2119 8.95477 7.6352 0.154 protocols.relax.FastRelax: {0} CMD: min -66.5057 8.88928 7.57796 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -66.5057 8.88928 7.57796 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -58.9505 8.88928 7.57796 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 615 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -58.9711 8.88928 7.57796 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -58.3796 8.88928 7.57796 0.31955 protocols.relax.FastRelax: {0} CMD: min -59.7633 8.83508 7.47682 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -59.7633 8.83508 7.47682 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -51.2102 8.83508 7.47682 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 614 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -51.2489 8.83508 7.47682 0.55 protocols.relax.FastRelax: {0} CMD: min -53.1423 8.83211 7.46197 0.55 protocols.relax.FastRelax: {0} MRP: 4 -53.1423 -53.1423 8.83211 7.46197 protocols.relax.FastRelax: {0} CMD: accept_to_best -53.1423 8.83211 7.46197 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -53.1423 8.83211 7.46197 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_46.pdb protocols.relax.FastRelax: {0} CMD: repeat 14964.1 7.75248 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14964.1 7.75248 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2335.58 7.75248 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 773 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 99.8194 7.75248 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 111.594 7.75248 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 2.92429 8.02022 3.46914 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 2.92429 8.02022 3.46914 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 130.793 8.02022 3.46914 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 761 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 105.961 8.02022 3.46914 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 112.955 8.02022 3.46914 0.154 protocols.relax.FastRelax: {0} CMD: min -22.9502 8.69886 4.51273 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.9502 8.69886 4.51273 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.7991 8.69886 4.51273 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 736 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.5405 8.69886 4.51273 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.9371 8.69886 4.51273 0.31955 protocols.relax.FastRelax: {0} CMD: min -15.9925 8.70954 4.50755 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.9925 8.70954 4.50755 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.86998 8.70954 4.50755 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 748 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -6.87031 8.70954 4.50755 0.55 protocols.relax.FastRelax: {0} CMD: min -19.5618 9.37508 5.73537 0.55 protocols.relax.FastRelax: {0} MRP: 0 -19.5618 -19.5618 9.37508 5.73537 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.5618 9.37508 5.73537 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.5618 9.37508 5.73537 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.5618 9.37508 5.73537 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.9686 9.37508 5.73537 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 705 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.3287 9.37508 5.73537 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.8274 9.37508 5.73537 0.02805 protocols.relax.FastRelax: {0} CMD: min -41.271 9.38928 5.95362 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.271 9.38928 5.95362 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.8598 9.38928 5.95362 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 793 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.5413 9.38928 5.95362 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.3436 9.38928 5.95362 0.154 protocols.relax.FastRelax: {0} CMD: min -33.5829 9.38531 5.80003 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.5829 9.38531 5.80003 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9049 9.38531 5.80003 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 739 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9136 9.38531 5.80003 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.3089 9.38531 5.80003 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.877 9.38708 5.79331 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.877 9.38708 5.79331 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.5879 9.38708 5.79331 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 732 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.6377 9.38708 5.79331 0.55 protocols.relax.FastRelax: {0} CMD: min -20.0063 9.40969 5.79384 0.55 protocols.relax.FastRelax: {0} MRP: 1 -20.0063 -20.0063 9.40969 5.79384 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.0063 9.40969 5.79384 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.0063 9.40969 5.79384 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.0063 9.40969 5.79384 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.6248 9.40969 5.79384 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 701 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.8976 9.40969 5.79384 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.4428 9.40969 5.79384 0.02805 protocols.relax.FastRelax: {0} CMD: min -39.9784 9.43217 5.84172 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.9784 9.43217 5.84172 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.8608 9.43217 5.84172 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.9547 9.43217 5.84172 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.3043 9.43217 5.84172 0.154 protocols.relax.FastRelax: {0} CMD: min -34.0017 9.40235 5.83994 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.0017 9.40235 5.83994 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.1012 9.40235 5.83994 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 736 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.1037 9.40235 5.83994 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.481 9.40235 5.83994 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.2004 9.39613 5.82393 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.2004 9.39613 5.82393 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.059 9.39613 5.82393 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 728 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.2267 9.39613 5.82393 0.55 protocols.relax.FastRelax: {0} CMD: min -20.0071 9.41407 5.80631 0.55 protocols.relax.FastRelax: {0} MRP: 2 -20.0071 -20.0071 9.41407 5.80631 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.0071 9.41407 5.80631 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.0071 9.41407 5.80631 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.0071 9.41407 5.80631 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.6464 9.41407 5.80631 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.9188 9.41407 5.80631 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.4605 9.41407 5.80631 0.02805 protocols.relax.FastRelax: {0} CMD: min -39.9741 9.43652 5.85348 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.9741 9.43652 5.85348 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.0168 9.43652 5.85348 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 654 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.1824 9.43652 5.85348 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.5476 9.43652 5.85348 0.154 protocols.relax.FastRelax: {0} CMD: min -33.9472 9.41011 5.86295 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.9472 9.41011 5.86295 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.8862 9.41011 5.86295 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 736 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.8887 9.41011 5.86295 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2533 9.41011 5.86295 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.0641 9.4006 5.84351 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.0641 9.4006 5.84351 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.8301 9.4006 5.84351 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 728 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.0236 9.4006 5.84351 0.55 protocols.relax.FastRelax: {0} CMD: min -20.0066 9.41538 5.80995 0.55 protocols.relax.FastRelax: {0} MRP: 3 -20.0066 -20.0071 9.41407 5.80631 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.0066 9.41538 5.80995 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.0066 9.41538 5.80995 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.0066 9.41538 5.80995 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.6459 9.41538 5.80995 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.0126 9.41538 5.80995 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.4975 9.41538 5.80995 0.02805 protocols.relax.FastRelax: {0} CMD: min -47.3249 9.60207 6.29117 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.3249 9.60207 6.29117 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.0539 9.60207 6.29117 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 791 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.5348 9.60207 6.29117 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.1363 9.60207 6.29117 0.154 protocols.relax.FastRelax: {0} CMD: min -35.7623 9.56159 6.18991 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.7623 9.56159 6.18991 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.3103 9.56159 6.18991 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 744 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.3104 9.56159 6.18991 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.565 9.56159 6.18991 0.31955 protocols.relax.FastRelax: {0} CMD: min -28.3624 9.55434 6.13906 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.3624 9.55434 6.13906 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.8485 9.55434 6.13906 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 644 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.8485 9.55434 6.13906 0.55 protocols.relax.FastRelax: {0} CMD: min -22.058 9.4735 6.03073 0.55 protocols.relax.FastRelax: {0} MRP: 4 -22.058 -22.058 9.4735 6.03073 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.058 9.4735 6.03073 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.058 9.4735 6.03073 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_26.pdb protocols.relax.FastRelax: {0} CMD: repeat 14506.3 10.2463 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14506.3 10.2463 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1843.38 10.2463 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 601 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 115.212 10.2463 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 130.008 10.2463 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 59.7133 10.1876 2.6526 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 59.7133 10.1876 2.6526 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 73.4575 10.1876 2.6526 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 606 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 64.3302 10.1876 2.6526 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 65.22 10.1876 2.6526 0.154 protocols.relax.FastRelax: {0} CMD: min 12.4965 9.80513 6.39985 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 12.4965 9.80513 6.39985 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 19.0974 9.80513 6.39985 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 685 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 16.7238 9.80513 6.39985 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 17.1774 9.80513 6.39985 0.31955 protocols.relax.FastRelax: {0} CMD: min 5.28984 9.57102 9.6354 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 5.28984 9.57102 9.6354 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 12.4901 9.57102 9.6354 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 650 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 10.2018 9.57102 9.6354 0.55 core.optimization.LineMinimizer: {0} [ ERROR ] Inaccurate G! step= 3.8147e-06 Deriv= -0.0108462 Finite Diff= 0.00618093 protocols.relax.FastRelax: {0} CMD: min 3.29149 8.2961 11.5995 0.55 protocols.relax.FastRelax: {0} MRP: 0 3.29149 3.29149 8.2961 11.5995 protocols.relax.FastRelax: {0} CMD: accept_to_best 3.29149 8.2961 11.5995 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat 3.29149 8.2961 11.5995 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 3.29149 8.2961 11.5995 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.8131 8.2961 11.5995 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 694 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.6772 8.2961 11.5995 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.3322 8.2961 11.5995 0.02805 protocols.relax.FastRelax: {0} CMD: min -18.4911 8.34247 11.3046 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.4911 8.34247 11.3046 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.98349 8.34247 11.3046 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.71965 8.34247 11.3046 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.78599 8.34247 11.3046 0.154 protocols.relax.FastRelax: {0} CMD: min -15.1892 8.4518 10.9659 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.1892 8.4518 10.9659 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.38818 8.4518 10.9659 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -7.46995 8.4518 10.9659 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.86849 8.4518 10.9659 0.31955 protocols.relax.FastRelax: {0} CMD: min -8.52855 8.43212 11.0585 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.52855 8.43212 11.0585 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.207688 8.43212 11.0585 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 632 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.213158 8.43212 11.0585 0.55 protocols.relax.FastRelax: {0} CMD: min -2.4767 8.75959 11.6405 0.55 protocols.relax.FastRelax: {0} MRP: 1 -2.4767 -2.4767 8.75959 11.6405 protocols.relax.FastRelax: {0} CMD: accept_to_best -2.4767 8.75959 11.6405 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -2.4767 8.75959 11.6405 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -2.4767 8.75959 11.6405 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.9469 8.75959 11.6405 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.3026 8.75959 11.6405 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.0967 8.75959 11.6405 0.02805 protocols.relax.FastRelax: {0} CMD: min -25.9868 8.85606 11.7272 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.9868 8.85606 11.7272 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.54897 8.85606 11.7272 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 657 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.97417 8.85606 11.7272 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.84838 8.85606 11.7272 0.154 protocols.relax.FastRelax: {0} CMD: min -16.1464 8.82186 11.5691 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.1464 8.82186 11.5691 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.78889 8.82186 11.5691 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -7.91866 8.82186 11.5691 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.27887 8.82186 11.5691 0.31955 protocols.relax.FastRelax: {0} CMD: min -9.17322 8.77197 11.5068 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.17322 8.77197 11.5068 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.718413 8.77197 11.5068 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.807653 8.77197 11.5068 0.55 protocols.relax.FastRelax: {0} CMD: min -2.34166 8.76435 11.5467 0.55 protocols.relax.FastRelax: {0} MRP: 2 -2.34166 -2.4767 8.75959 11.6405 protocols.relax.FastRelax: {0} CMD: accept_to_best -2.34166 8.76435 11.5467 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -2.34166 8.76435 11.5467 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -2.34166 8.76435 11.5467 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.8016 8.76435 11.5467 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.3198 8.76435 11.5467 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.1148 8.76435 11.5467 0.02805 protocols.relax.FastRelax: {0} CMD: min -26.2043 8.85343 11.5979 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.2043 8.85343 11.5979 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.33882 8.85343 11.5979 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.63931 8.85343 11.5979 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.48782 8.85343 11.5979 0.154 protocols.relax.FastRelax: {0} CMD: min -16.1726 8.82404 11.4631 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.1726 8.82404 11.4631 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.85803 8.82404 11.4631 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.04788 8.82404 11.4631 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.41647 8.82404 11.4631 0.31955 protocols.relax.FastRelax: {0} CMD: min -9.1637 8.79219 11.4381 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.1637 8.79219 11.4381 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.729983 8.79219 11.4381 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.790847 8.79219 11.4381 0.55 protocols.relax.FastRelax: {0} CMD: min -2.3413 8.76564 11.5477 0.55 protocols.relax.FastRelax: {0} MRP: 3 -2.3413 -2.4767 8.75959 11.6405 protocols.relax.FastRelax: {0} CMD: accept_to_best -2.3413 8.76564 11.5477 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -2.3413 8.76564 11.5477 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -2.3413 8.76564 11.5477 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.8012 8.76564 11.5477 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.3812 8.76564 11.5477 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.1756 8.76564 11.5477 0.02805 protocols.relax.FastRelax: {0} CMD: min -26.1817 8.85465 11.638 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.1817 8.85465 11.638 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.10354 8.85465 11.638 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 654 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.13992 8.85465 11.638 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.00483 8.85465 11.638 0.154 protocols.relax.FastRelax: {0} CMD: min -16.2125 8.84162 11.5449 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.2125 8.84162 11.5449 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.9781 8.84162 11.5449 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.10631 8.84162 11.5449 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.47558 8.84162 11.5449 0.31955 protocols.relax.FastRelax: {0} CMD: min -9.2916 8.7662 11.4684 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.2916 8.7662 11.4684 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.857163 8.7662 11.4684 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.945587 8.7662 11.4684 0.55 protocols.relax.FastRelax: {0} CMD: min -2.47422 8.75492 11.6282 0.55 protocols.relax.FastRelax: {0} MRP: 4 -2.47422 -2.4767 8.75959 11.6405 protocols.relax.FastRelax: {0} CMD: accept_to_best -2.47422 8.75492 11.6282 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -2.47422 8.75492 11.6282 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_22.pdb protocols.relax.FastRelax: {0} CMD: repeat 17925.6 7.33612 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 17925.6 7.33612 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2492.3 7.33612 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 720 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 94.9062 7.33612 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 117.569 7.33612 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.0646 7.69896 2.09388 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.0646 7.69896 2.09388 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.70459 7.69896 2.09388 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 979 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.77894 7.69896 2.09388 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.33124 7.69896 2.09388 0.154 protocols.relax.FastRelax: {0} CMD: min -40.2451 8.16414 3.82433 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.2451 8.16414 3.82433 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.4107 8.16414 3.82433 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 930 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.8161 8.16414 3.82433 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7456 8.16414 3.82433 0.31955 protocols.relax.FastRelax: {0} CMD: min -29.4815 8.15328 3.73737 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.4815 8.15328 3.73737 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7811 8.15328 3.73737 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 971 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7818 8.15328 3.73737 0.55 protocols.relax.FastRelax: {0} CMD: min -31.3886 9.03494 7.22166 0.55 protocols.relax.FastRelax: {0} MRP: 0 -31.3886 -31.3886 9.03494 7.22166 protocols.relax.FastRelax: {0} CMD: accept_to_best -31.3886 9.03494 7.22166 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -31.3886 9.03494 7.22166 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.3886 9.03494 7.22166 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.6562 9.03494 7.22166 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1004 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -55.1883 9.03494 7.22166 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -54.2746 9.03494 7.22166 0.02805 protocols.relax.FastRelax: {0} CMD: min -69.2807 9.19189 7.37468 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -69.2807 9.19189 7.37468 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.2463 9.19189 7.37468 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1028 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.1428 9.19189 7.37468 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.6084 9.19189 7.37468 0.154 protocols.relax.FastRelax: {0} CMD: min -51.7942 9.12439 7.30789 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -51.7942 9.12439 7.30789 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.6697 9.12439 7.30789 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1061 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.1399 9.12439 7.30789 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.1445 9.12439 7.30789 0.31955 protocols.relax.FastRelax: {0} CMD: min -48.5582 9.01375 7.40831 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -48.5582 9.01375 7.40831 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.681 9.01375 7.40831 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 975 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.6968 9.01375 7.40831 0.55 protocols.relax.FastRelax: {0} CMD: min -42.4254 8.96917 7.40589 0.55 protocols.relax.FastRelax: {0} MRP: 1 -42.4254 -42.4254 8.96917 7.40589 protocols.relax.FastRelax: {0} CMD: accept_to_best -42.4254 8.96917 7.40589 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -42.4254 8.96917 7.40589 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.4254 8.96917 7.40589 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -61.1538 8.96917 7.40589 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 985 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -63.9031 8.96917 7.40589 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -62.8846 8.96917 7.40589 0.02805 protocols.relax.FastRelax: {0} CMD: min -73.5477 9.07282 7.70155 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -73.5477 9.07282 7.70155 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.6264 9.07282 7.70155 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 975 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.7964 9.07282 7.70155 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.3001 9.07282 7.70155 0.154 protocols.relax.FastRelax: {0} CMD: min -60.1982 9.18143 7.708 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -60.1982 9.18143 7.708 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.0511 9.18143 7.708 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 960 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -47.958 9.18143 7.708 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.0439 9.18143 7.708 0.31955 protocols.relax.FastRelax: {0} CMD: min -50.0187 9.14467 7.63496 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.0187 9.14467 7.63496 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.7231 9.14467 7.63496 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1007 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.9732 9.14467 7.63496 0.55 protocols.relax.FastRelax: {0} CMD: min -43.6719 9.02875 7.42993 0.55 protocols.relax.FastRelax: {0} MRP: 2 -43.6719 -43.6719 9.02875 7.42993 protocols.relax.FastRelax: {0} CMD: accept_to_best -43.6719 9.02875 7.42993 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -43.6719 9.02875 7.42993 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.6719 9.02875 7.42993 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -62.474 9.02875 7.42993 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 987 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -65.0279 9.02875 7.42993 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -63.9461 9.02875 7.42993 0.02805 protocols.relax.FastRelax: {0} CMD: min -72.0677 8.99016 7.43821 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -72.0677 8.99016 7.43821 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.1117 8.99016 7.43821 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 989 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -56.8659 8.99016 7.43821 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -56.0408 8.99016 7.43821 0.154 protocols.relax.FastRelax: {0} CMD: min -60.7007 9.08807 7.48296 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -60.7007 9.08807 7.48296 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.6817 9.08807 7.48296 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 947 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.7002 9.08807 7.48296 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.8339 9.08807 7.48296 0.31955 protocols.relax.FastRelax: {0} CMD: min -50.6876 9.10696 7.44423 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.6876 9.10696 7.44423 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.8651 9.10696 7.44423 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 946 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.9551 9.10696 7.44423 0.55 protocols.relax.FastRelax: {0} CMD: min -43.7322 9.03045 7.42498 0.55 protocols.relax.FastRelax: {0} MRP: 3 -43.7322 -43.7322 9.03045 7.42498 protocols.relax.FastRelax: {0} CMD: accept_to_best -43.7322 9.03045 7.42498 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -43.7322 9.03045 7.42498 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.7322 9.03045 7.42498 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -62.5219 9.03045 7.42498 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 980 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -64.9305 9.03045 7.42498 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -63.8169 9.03045 7.42498 0.02805 protocols.relax.FastRelax: {0} CMD: min -73.7388 9.02305 7.49093 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -73.7388 9.02305 7.49093 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.9869 9.02305 7.49093 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 986 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -51.7701 9.02305 7.49093 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -50.4648 9.02305 7.49093 0.154 protocols.relax.FastRelax: {0} CMD: min -60.1463 9.11613 7.48734 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -60.1463 9.11613 7.48734 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.5255 9.11613 7.48734 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 1005 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.7918 9.11613 7.48734 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.9267 9.11613 7.48734 0.31955 protocols.relax.FastRelax: {0} CMD: min -50.2996 9.04133 7.43545 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.2996 9.04133 7.43545 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.201 9.04133 7.43545 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 960 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.202 9.04133 7.43545 0.55 protocols.relax.FastRelax: {0} CMD: min -43.7334 9.04412 7.40328 0.55 protocols.relax.FastRelax: {0} MRP: 4 -43.7334 -43.7334 9.04412 7.40328 protocols.relax.FastRelax: {0} CMD: accept_to_best -43.7334 9.04412 7.40328 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -43.7334 9.04412 7.40328 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_44.pdb protocols.relax.FastRelax: {0} CMD: repeat 10940.2 9.20145 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 10940.2 9.20145 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1605.46 9.20145 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 617 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 92.4032 9.20145 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 100.476 9.20145 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -17.4168 7.77915 5.04596 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.4168 7.77915 5.04596 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 10.9125 7.77915 5.04596 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.20938 7.77915 5.04596 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.778749 7.77915 5.04596 0.154 protocols.relax.FastRelax: {0} CMD: min -21.1981 7.71327 5.9274 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.1981 7.71327 5.9274 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.8722 7.71327 5.9274 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 681 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.1297 7.71327 5.9274 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.4179 7.71327 5.9274 0.31955 protocols.relax.FastRelax: {0} CMD: min -13.321 7.7285 5.88978 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.321 7.7285 5.88978 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.23691 7.7285 5.88978 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 660 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -1.38663 7.7285 5.88978 0.55 protocols.relax.FastRelax: {0} CMD: min -16.9724 8.00503 7.32596 0.55 protocols.relax.FastRelax: {0} MRP: 0 -16.9724 -16.9724 8.00503 7.32596 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.9724 8.00503 7.32596 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.9724 8.00503 7.32596 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.9724 8.00503 7.32596 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.8836 8.00503 7.32596 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.3425 8.00503 7.32596 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.1637 8.00503 7.32596 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.365 8.35249 8.22281 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.365 8.35249 8.22281 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.3352 8.35249 8.22281 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.9003 8.35249 8.22281 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.4805 8.35249 8.22281 0.154 protocols.relax.FastRelax: {0} CMD: min -32.672 8.15298 7.96754 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.672 8.15298 7.96754 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.1085 8.15298 7.96754 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.1199 8.15298 7.96754 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.5254 8.15298 7.96754 0.31955 protocols.relax.FastRelax: {0} CMD: min -24.9209 8.14723 7.97418 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.9209 8.14723 7.97418 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.4553 8.14723 7.97418 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 628 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.4668 8.14723 7.97418 0.55 protocols.relax.FastRelax: {0} CMD: min -20.103 8.17912 8.08503 0.55 protocols.relax.FastRelax: {0} MRP: 1 -20.103 -20.103 8.17912 8.08503 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.103 8.17912 8.08503 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.103 8.17912 8.08503 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.103 8.17912 8.08503 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.7055 8.17912 8.08503 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 672 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.7759 8.17912 8.08503 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5301 8.17912 8.08503 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.2964 8.19704 8.08812 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.2964 8.19704 8.08812 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.8376 8.19704 8.08812 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.8718 8.19704 8.08812 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.8873 8.19704 8.08812 0.154 protocols.relax.FastRelax: {0} CMD: min -32.6542 8.22883 8.09788 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.6542 8.22883 8.09788 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5752 8.22883 8.09788 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.7027 8.22883 8.09788 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2044 8.22883 8.09788 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.5654 8.22525 8.11002 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.5654 8.22525 8.11002 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7419 8.22525 8.11002 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 626 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7537 8.22525 8.11002 0.55 protocols.relax.FastRelax: {0} CMD: min -20.1031 8.17546 8.07755 0.55 protocols.relax.FastRelax: {0} MRP: 2 -20.1031 -20.1031 8.17546 8.07755 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.1031 8.17546 8.07755 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.1031 8.17546 8.07755 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.1031 8.17546 8.07755 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.6904 8.17546 8.07755 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.764 8.17546 8.07755 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.522 8.17546 8.07755 0.02805 protocols.relax.FastRelax: {0} CMD: min -36.9905 8.18427 8.10258 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.9905 8.18427 8.10258 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.1319 8.18427 8.10258 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.2451 8.18427 8.10258 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.2345 8.18427 8.10258 0.154 protocols.relax.FastRelax: {0} CMD: min -32.5088 8.21881 8.08464 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.5088 8.21881 8.08464 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5283 8.21881 8.08464 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.5499 8.21881 8.08464 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.0064 8.21881 8.08464 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.3837 8.22248 8.08604 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.3837 8.22248 8.08604 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.691 8.22248 8.08604 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.6397 8.22248 8.08604 0.55 protocols.relax.FastRelax: {0} CMD: min -20.1059 8.17467 8.06967 0.55 protocols.relax.FastRelax: {0} MRP: 3 -20.1059 -20.1059 8.17467 8.06967 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.1059 8.17467 8.06967 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.1059 8.17467 8.06967 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.1059 8.17467 8.06967 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.6868 8.17467 8.06967 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 672 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.7376 8.17467 8.06967 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.4945 8.17467 8.06967 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.2578 8.16628 8.12985 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.2578 8.16628 8.12985 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.5336 8.16628 8.12985 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.4894 8.16628 8.12985 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.7164 8.16628 8.12985 0.154 protocols.relax.FastRelax: {0} CMD: min -31.834 8.20698 8.10767 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.834 8.20698 8.10767 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9261 8.20698 8.10767 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9268 8.20698 8.10767 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.4612 8.20698 8.10767 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.7645 8.2021 8.10754 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.7645 8.2021 8.10754 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.4935 8.2021 8.10754 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 626 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.5034 8.2021 8.10754 0.55 protocols.relax.FastRelax: {0} CMD: min -20.104 8.17404 8.06728 0.55 protocols.relax.FastRelax: {0} MRP: 4 -20.104 -20.1059 8.17467 8.06967 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.104 8.17404 8.06728 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.104 8.17404 8.06728 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_14.pdb protocols.relax.FastRelax: {0} CMD: repeat 14380.1 8.33464 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14380.1 8.33464 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1837.44 8.33464 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 646 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 71.1031 8.33464 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 85.5245 8.33464 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -49.8686 7.91492 3.45169 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -49.8686 7.91492 3.45169 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.8062 7.91492 3.45169 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 830 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.5194 7.91492 3.45169 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.6029 7.91492 3.45169 0.154 protocols.relax.FastRelax: {0} CMD: min -41.449 7.8459 3.36653 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.449 7.8459 3.36653 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.3426 7.8459 3.36653 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 782 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.4458 7.8459 3.36653 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.5674 7.8459 3.36653 0.31955 protocols.relax.FastRelax: {0} CMD: min -30.1074 7.84522 3.35194 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.1074 7.84522 3.35194 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.3145 7.84522 3.35194 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 753 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.6062 7.84522 3.35194 0.55 protocols.relax.FastRelax: {0} CMD: min -27.4033 7.78447 3.69503 0.55 protocols.relax.FastRelax: {0} MRP: 0 -27.4033 -27.4033 7.78447 3.69503 protocols.relax.FastRelax: {0} CMD: accept_to_best -27.4033 7.78447 3.69503 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -27.4033 7.78447 3.69503 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.4033 7.78447 3.69503 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.5343 7.78447 3.69503 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 852 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.3475 7.78447 3.69503 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.9359 7.78447 3.69503 0.02805 protocols.relax.FastRelax: {0} CMD: min -62.8288 7.72186 3.72317 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -62.8288 7.72186 3.72317 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.4394 7.72186 3.72317 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 816 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.7685 7.72186 3.72317 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.3897 7.72186 3.72317 0.154 protocols.relax.FastRelax: {0} CMD: min -50.7628 7.73906 3.75925 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.7628 7.73906 3.75925 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.8041 7.73906 3.75925 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 798 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.8054 7.73906 3.75925 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.9413 7.73906 3.75925 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.1604 7.75442 3.74431 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.1604 7.75442 3.74431 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.1836 7.75442 3.74431 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 768 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.2306 7.75442 3.74431 0.55 protocols.relax.FastRelax: {0} CMD: min -35.9776 7.95746 4.05282 0.55 protocols.relax.FastRelax: {0} MRP: 1 -35.9776 -35.9776 7.95746 4.05282 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.9776 7.95746 4.05282 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.9776 7.95746 4.05282 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.9776 7.95746 4.05282 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -54.9314 7.95746 4.05282 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 809 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -56.26 7.95746 4.05282 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -55.9094 7.95746 4.05282 0.02805 protocols.relax.FastRelax: {0} CMD: min -61.1692 7.86463 4.18803 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -61.1692 7.86463 4.18803 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.0286 7.86463 4.18803 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 773 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -47.4399 7.86463 4.18803 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.4858 7.86463 4.18803 0.154 protocols.relax.FastRelax: {0} CMD: min -52.5116 7.90564 4.10152 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.5116 7.90564 4.10152 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.4559 7.90564 4.10152 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 738 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -43.4576 7.90564 4.10152 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.7438 7.90564 4.10152 0.31955 protocols.relax.FastRelax: {0} CMD: min -43.2912 7.91141 4.09117 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.2912 7.91141 4.09117 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.6634 7.91141 4.09117 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 724 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.6644 7.91141 4.09117 0.55 protocols.relax.FastRelax: {0} CMD: min -38.8152 7.9574 3.89942 0.55 protocols.relax.FastRelax: {0} MRP: 2 -38.8152 -38.8152 7.9574 3.89942 protocols.relax.FastRelax: {0} CMD: accept_to_best -38.8152 7.9574 3.89942 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -38.8152 7.9574 3.89942 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.8152 7.9574 3.89942 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -58.4424 7.9574 3.89942 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 810 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -59.394 7.9574 3.89942 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -59.0254 7.9574 3.89942 0.02805 protocols.relax.FastRelax: {0} CMD: min -65.3353 7.83834 4.03351 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -65.3353 7.83834 4.03351 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.856 7.83834 4.03351 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 788 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.5408 7.83834 4.03351 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.1336 7.83834 4.03351 0.154 protocols.relax.FastRelax: {0} CMD: min -54.721 7.91255 3.98136 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.721 7.91255 3.98136 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.5761 7.91255 3.98136 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 761 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -45.6266 7.91255 3.98136 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.8252 7.91255 3.98136 0.31955 protocols.relax.FastRelax: {0} CMD: min -46.786 7.94277 3.95176 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.786 7.94277 3.95176 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.3377 7.94277 3.95176 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 738 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.3604 7.94277 3.95176 0.55 protocols.relax.FastRelax: {0} CMD: min -39.295 7.93007 3.84567 0.55 protocols.relax.FastRelax: {0} MRP: 3 -39.295 -39.295 7.93007 3.84567 protocols.relax.FastRelax: {0} CMD: accept_to_best -39.295 7.93007 3.84567 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -39.295 7.93007 3.84567 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.295 7.93007 3.84567 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -58.7165 7.93007 3.84567 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 832 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -59.9529 7.93007 3.84567 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -59.5417 7.93007 3.84567 0.02805 protocols.relax.FastRelax: {0} CMD: min -63.5034 7.81569 3.93707 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -63.5034 7.81569 3.93707 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.0063 7.81569 3.93707 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 800 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.9267 7.81569 3.93707 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.9294 7.81569 3.93707 0.154 protocols.relax.FastRelax: {0} CMD: min -55.4349 7.86804 3.90386 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -55.4349 7.86804 3.90386 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.1815 7.86804 3.90386 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 780 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -46.7816 7.86804 3.90386 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.0558 7.86804 3.90386 0.31955 protocols.relax.FastRelax: {0} CMD: min -46.6409 7.87117 3.9005 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.6409 7.87117 3.9005 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.8031 7.87117 3.9005 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 744 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.8062 7.87117 3.9005 0.55 protocols.relax.FastRelax: {0} CMD: min -40.8232 7.9367 3.86474 0.55 protocols.relax.FastRelax: {0} MRP: 4 -40.8232 -40.8232 7.9367 3.86474 protocols.relax.FastRelax: {0} CMD: accept_to_best -40.8232 7.9367 3.86474 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -40.8232 7.9367 3.86474 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_12.pdb protocols.relax.FastRelax: {0} CMD: repeat 14637.8 7.02406 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14637.8 7.02406 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1832.43 7.02406 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 698 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 56.8885 7.02406 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 62.9561 7.02406 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 166.476 8.00706 4.76828 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 166.476 8.00706 4.76828 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 977.646 8.00706 4.76828 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 684 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 605.651 8.00706 4.76828 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 641.683 8.00706 4.76828 0.154 protocols.relax.FastRelax: {0} CMD: min -20.472 8.36251 5.17487 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.472 8.36251 5.17487 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.0123 8.36251 5.17487 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 672 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.5118 8.36251 5.17487 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.8036 8.36251 5.17487 0.31955 protocols.relax.FastRelax: {0} CMD: min -15.5521 8.51448 5.32334 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.5521 8.51448 5.32334 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.0806 8.51448 5.32334 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 657 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -7.14495 8.51448 5.32334 0.55 protocols.relax.FastRelax: {0} CMD: min -26.4449 8.7229 5.08343 0.55 protocols.relax.FastRelax: {0} MRP: 0 -26.4449 -26.4449 8.7229 5.08343 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.4449 8.7229 5.08343 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.4449 8.7229 5.08343 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.4449 8.7229 5.08343 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.0553 8.7229 5.08343 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 736 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.6917 8.7229 5.08343 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.9674 8.7229 5.08343 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.4812 8.74731 5.08921 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.4812 8.74731 5.08921 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4044 8.74731 5.08921 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.3548 8.74731 5.08921 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.9445 8.74731 5.08921 0.154 protocols.relax.FastRelax: {0} CMD: min -37.0551 8.74788 5.09358 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.0551 8.74788 5.09358 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.47 8.74788 5.09358 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 687 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.5382 8.74788 5.09358 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.9506 8.74788 5.09358 0.31955 protocols.relax.FastRelax: {0} CMD: min -35.2848 8.95135 5.21289 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.2848 8.95135 5.21289 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2312 8.95135 5.21289 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.2567 8.95135 5.21289 0.55 protocols.relax.FastRelax: {0} CMD: min -35.9479 9.10885 5.31048 0.55 protocols.relax.FastRelax: {0} MRP: 1 -35.9479 -35.9479 9.10885 5.31048 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.9479 9.10885 5.31048 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.9479 9.10885 5.31048 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.9479 9.10885 5.31048 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.1974 9.10885 5.31048 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 757 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.6539 9.10885 5.31048 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -50.0137 9.10885 5.31048 0.02805 protocols.relax.FastRelax: {0} CMD: min -50.2313 9.11271 5.3119 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.2313 9.11271 5.3119 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.6708 9.11271 5.3119 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 716 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.4252 9.11271 5.3119 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.8678 9.11271 5.3119 0.154 protocols.relax.FastRelax: {0} CMD: min -43.2663 9.13492 5.29257 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.2663 9.13492 5.29257 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.9108 9.13492 5.29257 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 705 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.1086 9.13492 5.29257 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.535 9.13492 5.29257 0.31955 protocols.relax.FastRelax: {0} CMD: min -38.6521 9.13174 5.36858 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.6521 9.13174 5.36858 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31 9.13174 5.36858 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 684 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.0046 9.13174 5.36858 0.55 protocols.relax.FastRelax: {0} CMD: min -35.9921 9.10292 5.33097 0.55 protocols.relax.FastRelax: {0} MRP: 2 -35.9921 -35.9921 9.10292 5.33097 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.9921 9.10292 5.33097 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.9921 9.10292 5.33097 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.9921 9.10292 5.33097 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.3096 9.10292 5.33097 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 754 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -50.5733 9.10292 5.33097 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.9223 9.10292 5.33097 0.02805 protocols.relax.FastRelax: {0} CMD: min -50.1384 9.10675 5.3323 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -50.1384 9.10675 5.3323 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.3681 9.10675 5.3323 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 712 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.3216 9.10675 5.3323 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.7551 9.10675 5.3323 0.154 protocols.relax.FastRelax: {0} CMD: min -43.2346 9.13139 5.31182 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.2346 9.13139 5.31182 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.8585 9.13139 5.31182 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 703 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.0831 9.13139 5.31182 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.5073 9.13139 5.31182 0.31955 protocols.relax.FastRelax: {0} CMD: min -39.2439 9.1061 5.35259 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.2439 9.1061 5.35259 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.7564 9.1061 5.35259 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 684 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.7564 9.1061 5.35259 0.55 protocols.relax.FastRelax: {0} CMD: min -32.1634 9.09966 5.34032 0.55 protocols.relax.FastRelax: {0} MRP: 3 -32.1634 -35.9921 9.10292 5.33097 protocols.relax.FastRelax: {0} CMD: accept_to_best -32.1634 9.09966 5.34032 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -32.1634 9.09966 5.34032 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.1634 9.09966 5.34032 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.0067 9.09966 5.34032 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 756 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.5604 9.09966 5.34032 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -49.0586 9.09966 5.34032 0.02805 protocols.relax.FastRelax: {0} CMD: min -49.5875 9.10744 5.33115 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -49.5875 9.10744 5.33115 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.5829 9.10744 5.33115 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 713 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.6668 9.10744 5.33115 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.3603 9.10744 5.33115 0.154 protocols.relax.FastRelax: {0} CMD: min -44.4963 9.10947 5.3325 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.4963 9.10947 5.3325 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.729 9.10947 5.3325 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 705 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.6342 9.10947 5.3325 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.2525 9.10947 5.3325 0.31955 protocols.relax.FastRelax: {0} CMD: min -39.2656 9.10917 5.33191 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.2656 9.10917 5.33191 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.978 9.10917 5.33191 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 683 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.978 9.10917 5.33191 0.55 protocols.relax.FastRelax: {0} CMD: min -35.9919 9.1033 5.32983 0.55 protocols.relax.FastRelax: {0} MRP: 4 -35.9919 -35.9921 9.10292 5.33097 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.9919 9.1033 5.32983 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.9919 9.1033 5.32983 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_7.pdb protocols.relax.FastRelax: {0} CMD: repeat 12370.6 6.0802 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 12370.6 6.0802 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2298.9 6.0802 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 684 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 61.3925 6.0802 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 63.4077 6.0802 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 63.3476 6.08053 0.00958421 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 63.3476 6.08053 0.00958421 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 102.463 6.08053 0.00958421 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 87.3654 6.08053 0.00958421 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 88.5272 6.08053 0.00958421 0.154 protocols.relax.FastRelax: {0} CMD: min 35.7112 6.34855 2.61013 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 35.7112 6.34855 2.61013 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 46.9116 6.34855 2.61013 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 34.896 6.34855 2.61013 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 35.3584 6.34855 2.61013 0.31955 protocols.relax.FastRelax: {0} CMD: min 35.2482 6.34588 2.61348 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 35.2482 6.34588 2.61348 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 44.0578 6.34588 2.61348 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 644 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 43.8171 6.34588 2.61348 0.55 protocols.relax.FastRelax: {0} CMD: min -10.2797 7.26287 4.55708 0.55 protocols.relax.FastRelax: {0} MRP: 0 -10.2797 -10.2797 7.26287 4.55708 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.2797 7.26287 4.55708 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.2797 7.26287 4.55708 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.2797 7.26287 4.55708 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.9447 7.26287 4.55708 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 650 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.5688 7.26287 4.55708 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.3783 7.26287 4.55708 0.02805 protocols.relax.FastRelax: {0} CMD: min -27.4442 7.2573 4.55553 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.4442 7.2573 4.55553 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.6091 7.2573 4.55553 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 618 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.8309 7.2573 4.55553 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.5986 7.2573 4.55553 0.154 protocols.relax.FastRelax: {0} CMD: min -23.6099 7.25764 4.55605 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.6099 7.25764 4.55605 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.2917 7.25764 4.55605 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 612 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.3124 7.25764 4.55605 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.9736 7.25764 4.55605 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.011 7.26125 4.55762 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.011 7.26125 4.55762 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.6045 7.26125 4.55762 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.6224 7.26125 4.55762 0.55 protocols.relax.FastRelax: {0} CMD: min -20.6449 7.89822 5.56875 0.55 protocols.relax.FastRelax: {0} MRP: 1 -20.6449 -20.6449 7.89822 5.56875 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.6449 7.89822 5.56875 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.6449 7.89822 5.56875 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.6449 7.89822 5.56875 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.1866 7.89822 5.56875 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.1575 7.89822 5.56875 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9728 7.89822 5.56875 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.0404 7.89678 5.5703 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.0404 7.89678 5.5703 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4204 7.89678 5.5703 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 614 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.5458 7.89678 5.5703 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.3222 7.89678 5.5703 0.154 protocols.relax.FastRelax: {0} CMD: min -30.3542 7.89956 5.57291 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3542 7.89956 5.57291 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.1976 7.89956 5.57291 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 606 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.3098 7.89956 5.57291 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.9933 7.89956 5.57291 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.0137 7.903 5.57456 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.0137 7.903 5.57456 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.0051 7.903 5.57456 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 600 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.0141 7.903 5.57456 0.55 protocols.relax.FastRelax: {0} CMD: min -20.9956 7.87978 5.5655 0.55 protocols.relax.FastRelax: {0} MRP: 2 -20.9956 -20.9956 7.87978 5.5655 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.9956 7.87978 5.5655 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.9956 7.87978 5.5655 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.9956 7.87978 5.5655 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.677 7.87978 5.5655 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 639 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.5282 7.87978 5.5655 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.3406 7.87978 5.5655 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.419 7.8759 5.56551 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.419 7.8759 5.56551 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.7346 7.8759 5.56551 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 616 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.9497 7.8759 5.56551 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.7247 7.8759 5.56551 0.154 protocols.relax.FastRelax: {0} CMD: min -30.7522 7.8781 5.56796 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.7522 7.8781 5.56796 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.5624 7.8781 5.56796 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.6684 7.8781 5.56796 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.3487 7.8781 5.56796 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.3582 7.88005 5.56866 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.3582 7.88005 5.56866 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.2772 7.88005 5.56866 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 603 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.2772 7.88005 5.56866 0.55 protocols.relax.FastRelax: {0} CMD: min -20.9971 7.8738 5.56172 0.55 protocols.relax.FastRelax: {0} MRP: 3 -20.9971 -20.9971 7.8738 5.56172 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.9971 7.8738 5.56172 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.9971 7.8738 5.56172 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.9971 7.8738 5.56172 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.6768 7.8738 5.56172 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 639 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.5431 7.8738 5.56172 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.3549 7.8738 5.56172 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.4329 7.86995 5.56174 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.4329 7.86995 5.56174 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.7356 7.86995 5.56174 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 617 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.9524 7.86995 5.56174 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.7267 7.86995 5.56174 0.154 protocols.relax.FastRelax: {0} CMD: min -30.7543 7.87218 5.56421 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.7543 7.87218 5.56421 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.5528 7.87218 5.56421 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.6509 7.87218 5.56421 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.3299 7.87218 5.56421 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.3393 7.87407 5.56487 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.3393 7.87407 5.56487 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.2317 7.87407 5.56487 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 603 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.2317 7.87407 5.56487 0.55 protocols.relax.FastRelax: {0} CMD: min -20.9975 7.87271 5.56047 0.55 protocols.relax.FastRelax: {0} MRP: 4 -20.9975 -20.9975 7.87271 5.56047 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.9975 7.87271 5.56047 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.9975 7.87271 5.56047 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_32.pdb protocols.relax.FastRelax: {0} CMD: repeat 14689.4 9.28722 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14689.4 9.28722 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1884.93 9.28722 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 598 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 81.0898 9.28722 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 84.4292 9.28722 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -6.69357 12.5425 14.0203 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -6.69357 12.5425 14.0203 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 9.96978 12.5425 14.0203 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 647 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 5.33685 12.5425 14.0203 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 6.47338 12.5425 14.0203 0.154 protocols.relax.FastRelax: {0} CMD: min -6.462 12.9971 15.2079 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -6.462 12.9971 15.2079 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.33945 12.9971 15.2079 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 674 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 1.86428 12.9971 15.2079 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.55041 12.9971 15.2079 0.31955 protocols.relax.FastRelax: {0} CMD: min -4.204 13.928 16.9706 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -4.204 13.928 16.9706 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.33574 13.928 16.9706 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 657 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 4.21539 13.928 16.9706 0.55 protocols.relax.FastRelax: {0} CMD: min -2.52662 13.852 17.3413 0.55 protocols.relax.FastRelax: {0} MRP: 0 -2.52662 -2.52662 13.852 17.3413 protocols.relax.FastRelax: {0} CMD: accept_to_best -2.52662 13.852 17.3413 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -2.52662 13.852 17.3413 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -2.52662 13.852 17.3413 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.5204 13.852 17.3413 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 681 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7089 13.852 17.3413 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.5249 13.852 17.3413 0.02805 protocols.relax.FastRelax: {0} CMD: min -16.5646 13.8496 17.3391 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.5646 13.8496 17.3391 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.9703 13.8496 17.3391 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.9704 13.8496 17.3391 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.7184 13.8496 17.3391 0.154 protocols.relax.FastRelax: {0} CMD: min -12.733 13.8483 17.338 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.733 13.8483 17.338 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.03799 13.8483 17.338 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 674 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.08631 13.8483 17.338 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.74141 13.8483 17.338 0.31955 protocols.relax.FastRelax: {0} CMD: min -7.74546 13.8481 17.338 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -7.74546 13.8481 17.338 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.17346 13.8481 17.338 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 670 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -1.17348 13.8481 17.338 0.55 protocols.relax.FastRelax: {0} CMD: min -4.77886 13.9664 17.6649 0.55 protocols.relax.FastRelax: {0} MRP: 1 -4.77886 -4.77886 13.9664 17.6649 protocols.relax.FastRelax: {0} CMD: accept_to_best -4.77886 13.9664 17.6649 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -4.77886 13.9664 17.6649 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -4.77886 13.9664 17.6649 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.0778 13.9664 17.6649 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 663 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.835 13.9664 17.6649 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5648 13.9664 17.6649 0.02805 protocols.relax.FastRelax: {0} CMD: min -20.6087 13.964 17.6629 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.6087 13.964 17.6629 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.34 13.964 17.6629 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.3403 13.964 17.6629 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.971 13.964 17.6629 0.154 protocols.relax.FastRelax: {0} CMD: min -15.0764 13.9621 17.661 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.0764 13.9621 17.661 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.30242 13.9621 17.661 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 655 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.3219 13.9621 17.661 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.95046 13.9621 17.661 0.31955 protocols.relax.FastRelax: {0} CMD: min -9.96259 13.9619 17.661 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.96259 13.9619 17.661 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -2.88931 13.9619 17.661 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 652 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.88931 13.9619 17.661 0.55 protocols.relax.FastRelax: {0} CMD: min -5.56727 13.9698 17.6769 0.55 protocols.relax.FastRelax: {0} MRP: 2 -5.56727 -5.56727 13.9698 17.6769 protocols.relax.FastRelax: {0} CMD: accept_to_best -5.56727 13.9698 17.6769 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -5.56727 13.9698 17.6769 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -5.56727 13.9698 17.6769 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.2054 13.9698 17.6769 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 664 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.7845 13.9698 17.6769 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5001 13.9698 17.6769 0.02805 protocols.relax.FastRelax: {0} CMD: min -20.5408 13.9675 17.6748 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.5408 13.9675 17.6748 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.0112 13.9675 17.6748 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.0113 13.9675 17.6748 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.6237 13.9675 17.6748 0.154 protocols.relax.FastRelax: {0} CMD: min -17.1092 14.1128 17.8481 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.1092 14.1128 17.8481 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.755 14.1128 17.8481 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.0887 14.1128 17.8481 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.6273 14.1128 17.8481 0.31955 protocols.relax.FastRelax: {0} CMD: min -10.6702 14.1077 17.8417 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.6702 14.1077 17.8417 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.89232 14.1077 17.8417 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -1.89278 14.1077 17.8417 0.55 protocols.relax.FastRelax: {0} CMD: min -6.93008 13.9648 17.6699 0.55 protocols.relax.FastRelax: {0} MRP: 3 -6.93008 -6.93008 13.9648 17.6699 protocols.relax.FastRelax: {0} CMD: accept_to_best -6.93008 13.9648 17.6699 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -6.93008 13.9648 17.6699 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -6.93008 13.9648 17.6699 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.8875 13.9648 17.6699 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 683 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.3968 13.9648 17.6699 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.2212 13.9648 17.6699 0.02805 protocols.relax.FastRelax: {0} CMD: min -21.269 13.9627 17.6681 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.269 13.9627 17.6681 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.8404 13.9627 17.6681 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.8404 13.9627 17.6681 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.6001 13.9627 17.6681 0.154 protocols.relax.FastRelax: {0} CMD: min -17.6248 13.9615 17.6671 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6248 13.9615 17.6671 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.1441 13.9615 17.6671 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 674 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.1441 13.9615 17.6671 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.7907 13.9615 17.6671 0.31955 protocols.relax.FastRelax: {0} CMD: min -12.7978 13.9613 17.6669 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.7978 13.9613 17.6669 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.06131 13.9613 17.6669 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 671 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -6.06132 13.9613 17.6669 0.55 protocols.relax.FastRelax: {0} CMD: min -6.93399 13.9711 17.6786 0.55 protocols.relax.FastRelax: {0} MRP: 4 -6.93399 -6.93399 13.9711 17.6786 protocols.relax.FastRelax: {0} CMD: accept_to_best -6.93399 13.9711 17.6786 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -6.93399 13.9711 17.6786 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_49.pdb protocols.relax.FastRelax: {0} CMD: repeat 14847.9 9.21942 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14847.9 9.21942 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1840.27 9.21942 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 556 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 90.1026 9.21942 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 97.3927 9.21942 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -14.0342 8.72855 2.39944 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.0342 8.72855 2.39944 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.0561673 8.72855 2.39944 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 615 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.45291 8.72855 2.39944 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.61816 8.72855 2.39944 0.154 protocols.relax.FastRelax: {0} CMD: min -22.3803 8.81978 2.96907 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.3803 8.81978 2.96907 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.6646 8.81978 2.96907 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 603 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.9634 8.81978 2.96907 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.4335 8.81978 2.96907 0.31955 protocols.relax.FastRelax: {0} CMD: min -15.5581 8.81146 2.97573 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.5581 8.81146 2.97573 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -5.62291 8.81146 2.97573 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 591 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -5.69457 8.81146 2.97573 0.55 protocols.relax.FastRelax: {0} CMD: min -19.8545 9.01636 4.10729 0.55 protocols.relax.FastRelax: {0} MRP: 0 -19.8545 -19.8545 9.01636 4.10729 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.8545 9.01636 4.10729 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.8545 9.01636 4.10729 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.8545 9.01636 4.10729 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.0596 9.01636 4.10729 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 708 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.1305 9.01636 4.10729 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.9176 9.01636 4.10729 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.0371 9.02057 4.10437 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.0371 9.02057 4.10437 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.8584 9.02057 4.10437 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.7016 9.02057 4.10437 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.4783 9.02057 4.10437 0.154 protocols.relax.FastRelax: {0} CMD: min -31.5009 9.02091 4.10432 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.5009 9.02091 4.10432 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.3313 9.02091 4.10432 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 622 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.3313 9.02091 4.10432 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.0025 9.02091 4.10432 0.31955 protocols.relax.FastRelax: {0} CMD: min -27.0153 9.01863 4.10623 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.0153 9.01863 4.10623 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7692 9.01863 4.10623 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 613 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.7692 9.01863 4.10623 0.55 protocols.relax.FastRelax: {0} CMD: min -22.2705 9.253 4.31543 0.55 protocols.relax.FastRelax: {0} MRP: 1 -22.2705 -22.2705 9.253 4.31543 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.2705 9.253 4.31543 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.2705 9.253 4.31543 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.2705 9.253 4.31543 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.539 9.253 4.31543 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 706 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.0126 9.253 4.31543 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.8001 9.253 4.31543 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.9198 9.25655 4.31158 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.9198 9.25655 4.31158 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.7496 9.25655 4.31158 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.6099 9.25655 4.31158 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.389 9.25655 4.31158 0.154 protocols.relax.FastRelax: {0} CMD: min -32.4117 9.25677 4.31109 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.4117 9.25677 4.31109 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2857 9.25677 4.31109 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.2857 9.25677 4.31109 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.9604 9.25677 4.31109 0.31955 protocols.relax.FastRelax: {0} CMD: min -27.973 9.25476 4.31296 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.973 9.25476 4.31296 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.7926 9.25476 4.31296 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.7926 9.25476 4.31296 0.55 protocols.relax.FastRelax: {0} CMD: min -22.2633 9.2561 4.33891 0.55 protocols.relax.FastRelax: {0} MRP: 2 -22.2633 -22.2705 9.253 4.31543 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.2633 9.2561 4.33891 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.2633 9.2561 4.33891 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.2633 9.2561 4.33891 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.5251 9.2561 4.33891 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 706 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.0089 9.2561 4.33891 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.7965 9.2561 4.33891 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.9158 9.25963 4.33504 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.9158 9.25963 4.33504 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.7469 9.25963 4.33504 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.6042 9.25963 4.33504 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.3829 9.25963 4.33504 0.154 protocols.relax.FastRelax: {0} CMD: min -32.4055 9.25982 4.33458 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.4055 9.25982 4.33458 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2728 9.25982 4.33458 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 620 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.2729 9.25982 4.33458 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.947 9.25982 4.33458 0.31955 protocols.relax.FastRelax: {0} CMD: min -27.9601 9.2578 4.33649 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.9601 9.2578 4.33649 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.7701 9.2578 4.33649 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.7701 9.2578 4.33649 0.55 protocols.relax.FastRelax: {0} CMD: min -22.2652 9.25675 4.34837 0.55 protocols.relax.FastRelax: {0} MRP: 3 -22.2652 -22.2705 9.253 4.31543 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.2652 9.25675 4.34837 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.2652 9.25675 4.34837 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.2652 9.25675 4.34837 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.5269 9.25675 4.34837 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 706 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.0072 9.25675 4.34837 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.7948 9.25675 4.34837 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.9135 9.26027 4.34447 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.9135 9.26027 4.34447 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.7457 9.26027 4.34447 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.6038 9.26027 4.34447 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.3827 9.26027 4.34447 0.154 protocols.relax.FastRelax: {0} CMD: min -32.4051 9.26047 4.34398 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.4051 9.26047 4.34398 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.2767 9.26047 4.34398 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.2767 9.26047 4.34398 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.9512 9.26047 4.34398 0.31955 protocols.relax.FastRelax: {0} CMD: min -27.9643 9.25845 4.34588 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.9643 9.25845 4.34588 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.781 9.25845 4.34588 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.781 9.25845 4.34588 0.55 protocols.relax.FastRelax: {0} CMD: min -22.265 9.25639 4.34573 0.55 protocols.relax.FastRelax: {0} MRP: 4 -22.265 -22.2705 9.253 4.31543 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.265 9.25639 4.34573 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.265 9.25639 4.34573 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_5.pdb protocols.relax.FastRelax: {0} CMD: repeat 14367.1 8.59706 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14367.1 8.59706 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1865.63 8.59706 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 54.9894 8.59706 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 58.7697 8.59706 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 58.6866 8.5993 0.0117046 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 58.6866 8.5993 0.0117046 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 131.97 8.5993 0.0117046 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 594 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 122.819 8.5993 0.0117046 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 127.135 8.5993 0.0117046 0.154 protocols.relax.FastRelax: {0} CMD: min 1327.52 9.01483 6.08874 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 1327.52 9.01483 6.08874 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2698.66 9.01483 6.08874 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 628 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 2101.85 9.01483 6.08874 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2186.41 9.01483 6.08874 0.31955 protocols.relax.FastRelax: {0} CMD: min -8.19817 8.56185 4.85891 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.19817 8.56185 4.85891 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.485651 8.56185 4.85891 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 605 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.44525 8.56185 4.85891 0.55 protocols.relax.FastRelax: {0} CMD: min -28.6228 8.54259 5.04597 0.55 protocols.relax.FastRelax: {0} MRP: 0 -28.6228 -28.6228 8.54259 5.04597 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.6228 8.54259 5.04597 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.6228 8.54259 5.04597 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.6228 8.54259 5.04597 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.8525 8.54259 5.04597 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 620 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.079 8.54259 5.04597 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.8814 8.54259 5.04597 0.02805 protocols.relax.FastRelax: {0} CMD: min -42.6708 8.57711 5.0373 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.6708 8.57711 5.0373 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.9197 8.57711 5.0373 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 603 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.5691 8.57711 5.0373 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.1637 8.57711 5.0373 0.154 protocols.relax.FastRelax: {0} CMD: min -36.5432 8.5627 5.04928 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.5432 8.5627 5.04928 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.4174 8.5627 5.04928 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 597 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.0442 8.5627 5.04928 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.6818 8.5627 5.04928 0.31955 protocols.relax.FastRelax: {0} CMD: min -32.9582 8.55471 5.0457 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.9582 8.55471 5.0457 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.4024 8.55471 5.0457 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 591 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.6154 8.55471 5.0457 0.55 protocols.relax.FastRelax: {0} CMD: min -30.3157 8.653 4.88913 0.55 protocols.relax.FastRelax: {0} MRP: 1 -30.3157 -30.3157 8.653 4.88913 protocols.relax.FastRelax: {0} CMD: accept_to_best -30.3157 8.653 4.88913 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -30.3157 8.653 4.88913 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3157 8.653 4.88913 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.6708 8.653 4.88913 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.8865 8.653 4.88913 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.7239 8.653 4.88913 0.02805 protocols.relax.FastRelax: {0} CMD: min -49.0812 8.71871 4.62617 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -49.0812 8.71871 4.62617 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.1626 8.71871 4.62617 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 590 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.3107 8.71871 4.62617 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.2032 8.71871 4.62617 0.154 protocols.relax.FastRelax: {0} CMD: min -41.3938 8.78026 4.69074 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.3938 8.78026 4.69074 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5446 8.78026 4.69074 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 592 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.5455 8.78026 4.69074 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.006 8.78026 4.69074 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.2299 8.77001 4.68113 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.2299 8.77001 4.68113 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.7784 8.77001 4.68113 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 580 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.8161 8.77001 4.68113 0.55 protocols.relax.FastRelax: {0} CMD: min -30.3177 8.65779 4.9068 0.55 protocols.relax.FastRelax: {0} MRP: 2 -30.3177 -30.3177 8.65779 4.9068 protocols.relax.FastRelax: {0} CMD: accept_to_best -30.3177 8.65779 4.9068 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -30.3177 8.65779 4.9068 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3177 8.65779 4.9068 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.65 8.65779 4.9068 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 609 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -43.0967 8.65779 4.9068 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.5619 8.65779 4.9068 0.02805 protocols.relax.FastRelax: {0} CMD: min -51.2727 8.77662 4.68778 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -51.2727 8.77662 4.68778 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.5409 8.77662 4.68778 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 591 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.7696 8.77662 4.68778 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.9797 8.77662 4.68778 0.154 protocols.relax.FastRelax: {0} CMD: min -40.4277 8.80985 4.78132 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.4277 8.80985 4.78132 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.3694 8.80985 4.78132 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 593 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -33.4003 8.80985 4.78132 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.8445 8.80985 4.78132 0.31955 protocols.relax.FastRelax: {0} CMD: min -33.2 8.79697 4.77767 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.2 8.79697 4.77767 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.3817 8.79697 4.77767 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 587 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.4651 8.79697 4.77767 0.55 protocols.relax.FastRelax: {0} CMD: min -30.3173 8.6539 4.90573 0.55 protocols.relax.FastRelax: {0} MRP: 3 -30.3173 -30.3177 8.65779 4.9068 protocols.relax.FastRelax: {0} CMD: accept_to_best -30.3173 8.6539 4.90573 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -30.3173 8.6539 4.90573 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3173 8.6539 4.90573 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.6446 8.6539 4.90573 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 609 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.869 8.6539 4.90573 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.7079 8.6539 4.90573 0.02805 protocols.relax.FastRelax: {0} CMD: min -47.9125 8.64214 4.74776 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.9125 8.64214 4.74776 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.8744 8.64214 4.74776 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 594 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.3715 8.64214 4.74776 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4289 8.64214 4.74776 0.154 protocols.relax.FastRelax: {0} CMD: min -40.9878 8.72989 4.73807 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.9878 8.72989 4.73807 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5634 8.72989 4.73807 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 594 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.5775 8.72989 4.73807 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.0716 8.72989 4.73807 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.3248 8.72128 4.72896 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.3248 8.72128 4.72896 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.409 8.72128 4.72896 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 582 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.5875 8.72128 4.72896 0.55 protocols.relax.FastRelax: {0} CMD: min -30.2806 8.63286 4.84086 0.55 protocols.relax.FastRelax: {0} MRP: 4 -30.2806 -30.3177 8.65779 4.9068 protocols.relax.FastRelax: {0} CMD: accept_to_best -30.2806 8.63286 4.84086 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -30.2806 8.63286 4.84086 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_17.pdb protocols.relax.FastRelax: {0} CMD: repeat 13671.5 8.49434 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 13671.5 8.49434 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1892.04 8.49434 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 558 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 68.4432 8.49434 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 71.5877 8.49434 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -4.31223 10.2456 8.8241 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -4.31223 10.2456 8.8241 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 49.7982 10.2456 8.8241 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 24.4782 10.2456 8.8241 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 26.8922 10.2456 8.8241 0.154 protocols.relax.FastRelax: {0} CMD: min -14.2654 10.6429 8.41312 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.2654 10.6429 8.41312 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.83687 10.6429 8.41312 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 615 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.03805 10.6429 8.41312 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.61028 10.6429 8.41312 0.31955 protocols.relax.FastRelax: {0} CMD: min -8.66335 10.6429 8.4117 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.66335 10.6429 8.4117 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.559239 10.6429 8.4117 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.613099 10.6429 8.4117 0.55 protocols.relax.FastRelax: {0} CMD: min -17.6386 8.66366 8.36488 0.55 protocols.relax.FastRelax: {0} MRP: 0 -17.6386 -17.6386 8.66366 8.36488 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.6386 8.66366 8.36488 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.6386 8.66366 8.36488 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.6386 8.66366 8.36488 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.1802 8.66366 8.36488 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.327 8.66366 8.36488 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.1658 8.66366 8.36488 0.02805 protocols.relax.FastRelax: {0} CMD: min -30.2679 8.66346 8.36858 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.2679 8.66346 8.36858 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.1104 8.66346 8.36858 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 585 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1105 8.66346 8.36858 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.8892 8.66346 8.36858 0.154 protocols.relax.FastRelax: {0} CMD: min -26.955 8.66291 8.37003 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.955 8.66291 8.37003 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.826 8.66291 8.37003 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 582 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.3224 8.66291 8.37003 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.0446 8.66291 8.37003 0.31955 protocols.relax.FastRelax: {0} CMD: min -23.0601 8.66283 8.3718 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.0601 8.66283 8.3718 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.776 8.66283 8.3718 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 578 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.776 8.66283 8.3718 0.55 protocols.relax.FastRelax: {0} CMD: min -26.7062 9.01324 10.4978 0.55 protocols.relax.FastRelax: {0} MRP: 1 -26.7062 -26.7062 9.01324 10.4978 protocols.relax.FastRelax: {0} CMD: accept_to_best -26.7062 9.01324 10.4978 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -26.7062 9.01324 10.4978 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.7062 9.01324 10.4978 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.0299 9.01324 10.4978 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.0881 9.01324 10.4978 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.8999 9.01324 10.4978 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.0152 9.00128 10.6538 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.0152 9.00128 10.6538 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.707 9.00128 10.6538 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 597 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.0532 9.00128 10.6538 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.4796 9.00128 10.6538 0.154 protocols.relax.FastRelax: {0} CMD: min -31.3357 9.42688 11.0128 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.3357 9.42688 11.0128 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.425 9.42688 11.0128 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 587 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.6385 9.42688 11.0128 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2041 9.42688 11.0128 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.8409 9.41343 10.9885 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.8409 9.41343 10.9885 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.1736 9.41343 10.9885 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 581 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.1736 9.41343 10.9885 0.55 protocols.relax.FastRelax: {0} CMD: min -24.4717 9.52658 10.6949 0.55 protocols.relax.FastRelax: {0} MRP: 2 -24.4717 -26.7062 9.01324 10.4978 protocols.relax.FastRelax: {0} CMD: accept_to_best -24.4717 9.52658 10.6949 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -24.4717 9.52658 10.6949 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.4717 9.52658 10.6949 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.5071 9.52658 10.6949 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 616 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.939 9.52658 10.6949 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.246 9.52658 10.6949 0.02805 protocols.relax.FastRelax: {0} CMD: min -45.317 9.38359 10.7374 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.317 9.38359 10.7374 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.443 9.38359 10.7374 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 609 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.2216 9.38359 10.7374 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.3597 9.38359 10.7374 0.154 protocols.relax.FastRelax: {0} CMD: min -36.072 9.46652 10.7562 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.072 9.46652 10.7562 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.8778 9.46652 10.7562 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 600 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.9526 9.46652 10.7562 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.3851 9.46652 10.7562 0.31955 protocols.relax.FastRelax: {0} CMD: min -30.068 9.52275 10.78 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.068 9.52275 10.78 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.0476 9.52275 10.78 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 594 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.3239 9.52275 10.78 0.55 protocols.relax.FastRelax: {0} CMD: min -27.7682 9.78057 11.1577 0.55 protocols.relax.FastRelax: {0} MRP: 3 -27.7682 -27.7682 9.78057 11.1577 protocols.relax.FastRelax: {0} CMD: accept_to_best -27.7682 9.78057 11.1577 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -27.7682 9.78057 11.1577 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.7682 9.78057 11.1577 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.5868 9.78057 11.1577 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 606 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.9643 9.78057 11.1577 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.8051 9.78057 11.1577 0.02805 protocols.relax.FastRelax: {0} CMD: min -46.7423 9.77302 11.2259 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.7423 9.77302 11.2259 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.0889 9.77302 11.2259 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 603 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.614 9.77302 11.2259 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.9909 9.77302 11.2259 0.154 protocols.relax.FastRelax: {0} CMD: min -36.2652 9.85397 11.3353 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.2652 9.85397 11.3353 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.6578 9.85397 11.3353 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 607 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.7885 9.85397 11.3353 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.2684 9.85397 11.3353 0.31955 protocols.relax.FastRelax: {0} CMD: min -29.7503 9.85426 11.3244 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.7503 9.85426 11.3244 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5931 9.85426 11.3244 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 597 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.5965 9.85426 11.3244 0.55 protocols.relax.FastRelax: {0} CMD: min -25.5776 9.85806 11.3001 0.55 protocols.relax.FastRelax: {0} MRP: 4 -25.5776 -27.7682 9.78057 11.1577 protocols.relax.FastRelax: {0} CMD: accept_to_best -25.5776 9.85806 11.3001 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -25.5776 9.85806 11.3001 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_11.pdb protocols.relax.FastRelax: {0} CMD: repeat 15406.4 8.6875 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15406.4 8.6875 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1936.72 8.6875 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 155.149 8.6875 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 173.986 8.6875 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -32.5343 7.50217 7.80915 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.5343 7.50217 7.80915 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.8077 7.50217 7.80915 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 706 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.6356 7.50217 7.80915 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.431 7.50217 7.80915 0.154 protocols.relax.FastRelax: {0} CMD: min -33.8171 7.58441 7.50346 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.8171 7.58441 7.50346 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.6332 7.58441 7.50346 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 708 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.9187 7.58441 7.50346 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.3621 7.58441 7.50346 0.31955 protocols.relax.FastRelax: {0} CMD: min -26.6919 7.56495 7.48211 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.6919 7.56495 7.48211 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.4797 7.56495 7.48211 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 705 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.5204 7.56495 7.48211 0.55 protocols.relax.FastRelax: {0} CMD: min -27.2534 7.94071 8.31759 0.55 protocols.relax.FastRelax: {0} MRP: 0 -27.2534 -27.2534 7.94071 8.31759 protocols.relax.FastRelax: {0} CMD: accept_to_best -27.2534 7.94071 8.31759 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -27.2534 7.94071 8.31759 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.2534 7.94071 8.31759 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.1156 7.94071 8.31759 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 717 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -43.9389 7.94071 8.31759 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.7353 7.94071 8.31759 0.02805 protocols.relax.FastRelax: {0} CMD: min -43.8535 7.94128 8.30977 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -43.8535 7.94128 8.30977 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.8335 7.94128 8.30977 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.0113 7.94128 8.30977 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.7414 7.94128 8.30977 0.154 protocols.relax.FastRelax: {0} CMD: min -39.7911 7.94314 8.30816 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.7911 7.94314 8.30816 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.7534 7.94314 8.30816 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 698 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.7534 7.94314 8.30816 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.3562 7.94314 8.30816 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.4182 7.94618 8.31419 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.4182 7.94618 8.31419 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.9126 7.94618 8.31419 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 691 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.9126 7.94618 8.31419 0.55 protocols.relax.FastRelax: {0} CMD: min -29.4588 8.18481 8.76009 0.55 protocols.relax.FastRelax: {0} MRP: 1 -29.4588 -29.4588 8.18481 8.76009 protocols.relax.FastRelax: {0} CMD: accept_to_best -29.4588 8.18481 8.76009 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -29.4588 8.18481 8.76009 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.4588 8.18481 8.76009 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.3901 8.18481 8.76009 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 714 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -44.8408 8.18481 8.76009 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.6257 8.18481 8.76009 0.02805 protocols.relax.FastRelax: {0} CMD: min -44.7513 8.1848 8.75136 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -44.7513 8.1848 8.75136 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.5194 8.1848 8.75136 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 699 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.575 8.1848 8.75136 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.302 8.1848 8.75136 0.154 protocols.relax.FastRelax: {0} CMD: min -40.3536 8.18665 8.74937 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.3536 8.18665 8.74937 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.2592 8.18665 8.74937 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 695 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.4471 8.18665 8.74937 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.054 8.18665 8.74937 0.31955 protocols.relax.FastRelax: {0} CMD: min -35.1148 8.18968 8.75515 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.1148 8.18968 8.75515 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.6861 8.18968 8.75515 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 688 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.3215 8.18968 8.75515 0.55 protocols.relax.FastRelax: {0} CMD: min -29.7267 8.20119 8.74219 0.55 protocols.relax.FastRelax: {0} MRP: 2 -29.7267 -29.7267 8.20119 8.74219 protocols.relax.FastRelax: {0} CMD: accept_to_best -29.7267 8.20119 8.74219 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -29.7267 8.20119 8.74219 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.7267 8.20119 8.74219 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.5183 8.20119 8.74219 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 714 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -45.1258 8.20119 8.74219 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.9207 8.20119 8.74219 0.02805 protocols.relax.FastRelax: {0} CMD: min -45.0386 8.20122 8.7341 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.0386 8.20122 8.7341 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.9887 8.20122 8.7341 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 698 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.1714 8.20122 8.7341 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.8997 8.20122 8.7341 0.154 protocols.relax.FastRelax: {0} CMD: min -40.9489 8.20283 8.73227 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.9489 8.20283 8.73227 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.879 8.20283 8.73227 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 694 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.8958 8.20283 8.73227 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.5039 8.20283 8.73227 0.31955 protocols.relax.FastRelax: {0} CMD: min -35.5678 8.20595 8.73816 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.5678 8.20595 8.73816 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.1661 8.20595 8.73816 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 688 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.1661 8.20595 8.73816 0.55 protocols.relax.FastRelax: {0} CMD: min -29.7271 8.20616 8.73454 0.55 protocols.relax.FastRelax: {0} MRP: 3 -29.7271 -29.7271 8.20616 8.73454 protocols.relax.FastRelax: {0} CMD: accept_to_best -29.7271 8.20616 8.73454 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -29.7271 8.20616 8.73454 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.7271 8.20616 8.73454 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.5206 8.20616 8.73454 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 715 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -45.1371 8.20616 8.73454 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.9407 8.20616 8.73454 0.02805 protocols.relax.FastRelax: {0} CMD: min -45.0669 8.20605 8.72586 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.0669 8.20605 8.72586 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.1971 8.20605 8.72586 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 700 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.1971 8.20605 8.72586 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.9258 8.20605 8.72586 0.154 protocols.relax.FastRelax: {0} CMD: min -40.9747 8.20766 8.72404 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.9747 8.20766 8.72404 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.9112 8.20766 8.72404 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 696 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.9242 8.20766 8.72404 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.5327 8.20766 8.72404 0.31955 protocols.relax.FastRelax: {0} CMD: min -35.5934 8.21076 8.72993 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.5934 8.21076 8.72993 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.1975 8.21076 8.72993 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 690 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.1975 8.21076 8.72993 0.55 protocols.relax.FastRelax: {0} CMD: min -29.7267 8.20635 8.73151 0.55 protocols.relax.FastRelax: {0} MRP: 4 -29.7267 -29.7271 8.20616 8.73454 protocols.relax.FastRelax: {0} CMD: accept_to_best -29.7267 8.20635 8.73151 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -29.7267 8.20635 8.73151 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_39.pdb protocols.relax.FastRelax: {0} CMD: repeat 15591.4 8.184 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15591.4 8.184 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2013.55 8.184 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 70.1105 8.184 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 77.4298 8.184 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 97.6707 8.82366 6.8651 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 97.6707 8.82366 6.8651 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 292.237 8.82366 6.8651 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 55.4851 8.82366 6.8651 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 56.1504 8.82366 6.8651 0.154 protocols.relax.FastRelax: {0} CMD: min 56.0614 8.8272 6.85414 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 56.0614 8.8272 6.85414 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 68.4155 8.8272 6.85414 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 590 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 68.1246 8.8272 6.85414 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 69.0554 8.8272 6.85414 0.31955 protocols.relax.FastRelax: {0} CMD: min 68.9159 8.82788 6.83933 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 68.9159 8.82788 6.83933 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 86.5841 8.82788 6.83933 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 572 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 86.5835 8.82788 6.83933 0.55 protocols.relax.FastRelax: {0} CMD: min -8.81212 9.48887 8.93843 0.55 protocols.relax.FastRelax: {0} MRP: 0 -8.81212 -8.81212 9.48887 8.93843 protocols.relax.FastRelax: {0} CMD: accept_to_best -8.81212 9.48887 8.93843 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -8.81212 9.48887 8.93843 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.81212 9.48887 8.93843 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.4033 9.48887 8.93843 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 714 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.7873 9.48887 8.93843 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.5824 9.48887 8.93843 0.02805 protocols.relax.FastRelax: {0} CMD: min -24.6052 9.49052 8.94034 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.6052 9.49052 8.94034 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.6202 9.49052 8.94034 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 711 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.9768 9.49052 8.94034 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7634 9.49052 8.94034 0.154 protocols.relax.FastRelax: {0} CMD: min -20.7927 9.49429 8.94578 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.7927 9.49429 8.94578 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.8303 9.49429 8.94578 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 691 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.8304 9.49429 8.94578 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.5179 9.49429 8.94578 0.31955 protocols.relax.FastRelax: {0} CMD: min -16.5604 9.5005 8.95553 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.5604 9.5005 8.95553 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.6271 9.5005 8.95553 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 687 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.6418 9.5005 8.95553 0.55 protocols.relax.FastRelax: {0} CMD: min -13.994 9.92784 9.5497 0.55 protocols.relax.FastRelax: {0} MRP: 1 -13.994 -13.994 9.92784 9.5497 protocols.relax.FastRelax: {0} CMD: accept_to_best -13.994 9.92784 9.5497 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -13.994 9.92784 9.5497 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.994 9.92784 9.5497 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.7452 9.92784 9.5497 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 733 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.5232 9.92784 9.5497 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.3069 9.92784 9.5497 0.02805 protocols.relax.FastRelax: {0} CMD: min -27.3226 9.92383 9.54291 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.3226 9.92383 9.54291 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.1108 9.92383 9.54291 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 730 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.8985 9.92383 9.54291 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.689 9.92383 9.54291 0.154 protocols.relax.FastRelax: {0} CMD: min -23.6977 9.92131 9.53847 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.6977 9.92131 9.53847 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.7965 9.92131 9.53847 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 710 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.7965 9.92131 9.53847 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.4889 9.92131 9.53847 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.4923 9.92044 9.53692 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.4923 9.92044 9.53692 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.6321 9.92044 9.53692 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 705 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.6723 9.92044 9.53692 0.55 protocols.relax.FastRelax: {0} CMD: min -14.8638 10.1565 9.93186 0.55 protocols.relax.FastRelax: {0} MRP: 2 -14.8638 -14.8638 10.1565 9.93186 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.8638 10.1565 9.93186 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.8638 10.1565 9.93186 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.8638 10.1565 9.93186 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.6088 10.1565 9.93186 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 735 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.9908 10.1565 9.93186 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.7215 10.1565 9.93186 0.02805 protocols.relax.FastRelax: {0} CMD: min -27.7395 10.1519 9.92439 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.7395 10.1519 9.92439 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.5024 10.1519 9.92439 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 732 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.609 10.1519 9.92439 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.4037 10.1519 9.92439 0.154 protocols.relax.FastRelax: {0} CMD: min -24.413 10.1488 9.91921 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.413 10.1488 9.91921 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5912 10.1488 9.91921 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 711 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.5912 10.1488 9.91921 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.2898 10.1488 9.91921 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.2933 10.1476 9.91702 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.2933 10.1476 9.91702 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.552 10.1476 9.91702 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 704 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.5521 10.1476 9.91702 0.55 protocols.relax.FastRelax: {0} CMD: min -14.8646 10.1459 9.91098 0.55 protocols.relax.FastRelax: {0} MRP: 3 -14.8646 -14.8646 10.1459 9.91098 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.8646 10.1459 9.91098 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.8646 10.1459 9.91098 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.8646 10.1459 9.91098 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.6115 10.1459 9.91098 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 735 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.9892 10.1459 9.91098 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.7223 10.1459 9.91098 0.02805 protocols.relax.FastRelax: {0} CMD: min -27.7402 10.1413 9.90354 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.7402 10.1413 9.90354 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.5483 10.1413 9.90354 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 732 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.6034 10.1413 9.90354 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3984 10.1413 9.90354 0.154 protocols.relax.FastRelax: {0} CMD: min -24.4076 10.1383 9.89838 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.4076 10.1383 9.89838 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5901 10.1383 9.89838 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 711 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.5901 10.1383 9.89838 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.2891 10.1383 9.89838 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.2925 10.137 9.89621 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.2925 10.137 9.89621 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.5577 10.137 9.89621 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 704 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.5578 10.137 9.89621 0.55 protocols.relax.FastRelax: {0} CMD: min -14.865 10.1511 9.91255 0.55 protocols.relax.FastRelax: {0} MRP: 4 -14.865 -14.865 10.1511 9.91255 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.865 10.1511 9.91255 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.865 10.1511 9.91255 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_1.pdb protocols.relax.FastRelax: {0} CMD: repeat 16293.6 6.92407 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16293.6 6.92407 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2182.95 6.92407 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 146.028 6.92407 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 164.953 6.92407 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -32.3553 7.02407 2.95046 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.3553 7.02407 2.95046 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.5553 7.02407 2.95046 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 645 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.4463 7.02407 2.95046 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.007 7.02407 2.95046 0.154 protocols.relax.FastRelax: {0} CMD: min -29.1894 7.64723 3.47787 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.1894 7.64723 3.47787 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.5722 7.64723 3.47787 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.8028 7.64723 3.47787 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.0103 7.64723 3.47787 0.31955 protocols.relax.FastRelax: {0} CMD: min -22.0721 7.73755 3.48016 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.0721 7.73755 3.48016 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.312 7.73755 3.48016 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.3599 7.73755 3.48016 0.55 protocols.relax.FastRelax: {0} CMD: min -9.02288 9.06884 5.16064 0.55 protocols.relax.FastRelax: {0} MRP: 0 -9.02288 -9.02288 9.06884 5.16064 protocols.relax.FastRelax: {0} CMD: accept_to_best -9.02288 9.06884 5.16064 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -9.02288 9.06884 5.16064 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.02288 9.06884 5.16064 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -43.2027 9.06884 5.16064 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 709 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -45.3243 9.06884 5.16064 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -44.8655 9.06884 5.16064 0.02805 protocols.relax.FastRelax: {0} CMD: min -55.7184 9.13782 5.49754 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -55.7184 9.13782 5.49754 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4128 9.13782 5.49754 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 686 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.2055 9.13782 5.49754 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.7893 9.13782 5.49754 0.154 protocols.relax.FastRelax: {0} CMD: min -42.3673 9.15651 5.47679 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.3673 9.15651 5.47679 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.7146 9.15651 5.47679 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.7663 9.15651 5.47679 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.0045 9.15651 5.47679 0.31955 protocols.relax.FastRelax: {0} CMD: min -32.745 9.14343 5.45603 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.745 9.14343 5.45603 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.506 9.14343 5.45603 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 623 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.513 9.14343 5.45603 0.55 protocols.relax.FastRelax: {0} CMD: min -28.2195 9.34612 5.63452 0.55 protocols.relax.FastRelax: {0} MRP: 1 -28.2195 -28.2195 9.34612 5.63452 protocols.relax.FastRelax: {0} CMD: accept_to_best -28.2195 9.34612 5.63452 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -28.2195 9.34612 5.63452 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -28.2195 9.34612 5.63452 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -46.9489 9.34612 5.63452 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 719 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.8714 9.34612 5.63452 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.3616 9.34612 5.63452 0.02805 protocols.relax.FastRelax: {0} CMD: min -55.1173 9.4 5.77766 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -55.1173 9.4 5.77766 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.8657 9.4 5.77766 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 688 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.1516 9.4 5.77766 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9398 9.4 5.77766 0.154 protocols.relax.FastRelax: {0} CMD: min -41.4955 9.34783 5.67657 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.4955 9.34783 5.67657 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.7451 9.34783 5.67657 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.7078 9.34783 5.67657 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.8707 9.34783 5.67657 0.31955 protocols.relax.FastRelax: {0} CMD: min -36.2883 9.35144 5.66483 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.2883 9.35144 5.66483 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2582 9.35144 5.66483 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.2583 9.35144 5.66483 0.55 protocols.relax.FastRelax: {0} CMD: min -31.0858 9.26955 5.67528 0.55 protocols.relax.FastRelax: {0} MRP: 2 -31.0858 -31.0858 9.26955 5.67528 protocols.relax.FastRelax: {0} CMD: accept_to_best -31.0858 9.26955 5.67528 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -31.0858 9.26955 5.67528 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.0858 9.26955 5.67528 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -50.8471 9.26955 5.67528 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 777 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -52.7702 9.26955 5.67528 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.256 9.26955 5.67528 0.02805 protocols.relax.FastRelax: {0} CMD: min -60.3313 9.31984 5.8386 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -60.3313 9.31984 5.8386 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.2783 9.31984 5.8386 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 765 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -38.5524 9.31984 5.8386 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.2338 9.31984 5.8386 0.154 protocols.relax.FastRelax: {0} CMD: min -45.5637 9.30283 5.73893 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.5637 9.30283 5.73893 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.0572 9.30283 5.73893 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 697 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.5371 9.30283 5.73893 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.7034 9.30283 5.73893 0.31955 protocols.relax.FastRelax: {0} CMD: min -38.7788 9.31181 5.75404 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.7788 9.31181 5.75404 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.0781 9.31181 5.75404 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.0783 9.31181 5.75404 0.55 protocols.relax.FastRelax: {0} CMD: min -31.4073 9.26608 5.66635 0.55 protocols.relax.FastRelax: {0} MRP: 3 -31.4073 -31.4073 9.26608 5.66635 protocols.relax.FastRelax: {0} CMD: accept_to_best -31.4073 9.26608 5.66635 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -31.4073 9.26608 5.66635 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.4073 9.26608 5.66635 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -51.2383 9.26608 5.66635 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 782 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -53.1109 9.26608 5.66635 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -52.5987 9.26608 5.66635 0.02805 protocols.relax.FastRelax: {0} CMD: min -62.34 9.32757 5.88854 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -62.34 9.32757 5.88854 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.9808 9.32757 5.88854 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 753 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.896 9.32757 5.88854 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.0267 9.32757 5.88854 0.154 protocols.relax.FastRelax: {0} CMD: min -46.7934 9.3348 5.79036 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -46.7934 9.3348 5.79036 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.1541 9.3348 5.79036 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 684 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.4066 9.3348 5.79036 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.5523 9.3348 5.79036 0.31955 protocols.relax.FastRelax: {0} CMD: min -38.7095 9.33594 5.7783 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.7095 9.33594 5.7783 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.5542 9.33594 5.7783 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 672 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.845 9.33594 5.7783 0.55 protocols.relax.FastRelax: {0} CMD: min -31.402 9.27366 5.67789 0.55 protocols.relax.FastRelax: {0} MRP: 4 -31.402 -31.4073 9.26608 5.66635 protocols.relax.FastRelax: {0} CMD: accept_to_best -31.402 9.27366 5.67789 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -31.402 9.27366 5.67789 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_33.pdb protocols.relax.FastRelax: {0} CMD: repeat 13447.9 9.06459 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 13447.9 9.06459 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1753.16 9.06459 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 110.697 9.06459 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 119.922 9.06459 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -11.5485 15.1434 17.2329 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.5485 15.1434 17.2329 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.60929 15.1434 17.2329 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 0.58772 15.1434 17.2329 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1.50455 15.1434 17.2329 0.154 protocols.relax.FastRelax: {0} CMD: min -17.2519 16.8151 20.2299 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.2519 16.8151 20.2299 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.62387 16.8151 20.2299 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.99918 16.8151 20.2299 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.31081 16.8151 20.2299 0.31955 protocols.relax.FastRelax: {0} CMD: min -8.35005 16.8168 20.2322 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.35005 16.8168 20.2322 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 4.69966 16.8168 20.2322 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 4.42835 16.8168 20.2322 0.55 protocols.relax.FastRelax: {0} CMD: min -10.1206 19.495 23.841 0.55 protocols.relax.FastRelax: {0} MRP: 0 -10.1206 -10.1206 19.495 23.841 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.1206 19.495 23.841 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.1206 19.495 23.841 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.1206 19.495 23.841 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2051 19.495 23.841 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 667 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.6535 19.495 23.841 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.0877 19.495 23.841 0.02805 protocols.relax.FastRelax: {0} CMD: min -31.1098 19.4938 23.8396 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.1098 19.4938 23.8396 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.1302 19.4938 23.8396 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 646 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9299 19.4938 23.8396 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.6308 19.4938 23.8396 0.154 protocols.relax.FastRelax: {0} CMD: min -25.6374 19.4928 23.8385 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.6374 19.4928 23.8385 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.0699 19.4928 23.8385 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 641 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.07 19.4928 23.8385 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.631 19.4928 23.8385 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.6352 19.4927 23.8384 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.6352 19.4927 23.8384 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.277 19.4927 23.8384 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.277 19.4927 23.8384 0.55 protocols.relax.FastRelax: {0} CMD: min -14.8725 18.4163 22.5062 0.55 protocols.relax.FastRelax: {0} MRP: 1 -14.8725 -14.8725 18.4163 22.5062 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.8725 18.4163 22.5062 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.8725 18.4163 22.5062 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.8725 18.4163 22.5062 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.5361 18.4163 22.5062 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.2707 18.4163 22.5062 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.7227 18.4163 22.5062 0.02805 protocols.relax.FastRelax: {0} CMD: min -31.7446 18.4152 22.5048 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.7446 18.4152 22.5048 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1132 18.4152 22.5048 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 642 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.102 18.4152 22.5048 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.8216 18.4152 22.5048 0.154 protocols.relax.FastRelax: {0} CMD: min -26.8277 18.4144 22.5039 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.8277 18.4144 22.5039 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.6089 18.4144 22.5039 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 638 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.609 18.4144 22.5039 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1975 18.4144 22.5039 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.2012 18.4144 22.504 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2012 18.4144 22.504 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.3664 18.4144 22.504 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.3664 18.4144 22.504 0.55 protocols.relax.FastRelax: {0} CMD: min -14.8773 18.4773 22.5984 0.55 protocols.relax.FastRelax: {0} MRP: 2 -14.8773 -14.8773 18.4773 22.5984 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.8773 18.4773 22.5984 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.8773 18.4773 22.5984 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.8773 18.4773 22.5984 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.5523 18.4773 22.5984 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.2251 18.4773 22.5984 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.6817 18.4773 22.5984 0.02805 protocols.relax.FastRelax: {0} CMD: min -31.7034 18.4761 22.597 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.7034 18.4761 22.597 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1608 18.4761 22.597 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 641 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1069 18.4761 22.597 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.8278 18.4761 22.597 0.154 protocols.relax.FastRelax: {0} CMD: min -26.8339 18.4753 22.5961 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.8339 18.4753 22.5961 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.6383 18.4753 22.5961 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.6384 18.4753 22.5961 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.2287 18.4753 22.5961 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.2323 18.4752 22.5961 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2323 18.4752 22.5961 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.4322 18.4752 22.5961 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 631 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.4322 18.4752 22.5961 0.55 protocols.relax.FastRelax: {0} CMD: min -14.8823 18.4633 22.5845 0.55 protocols.relax.FastRelax: {0} MRP: 3 -14.8823 -14.8823 18.4633 22.5845 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.8823 18.4633 22.5845 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.8823 18.4633 22.5845 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.8823 18.4633 22.5845 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.5359 18.4633 22.5845 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.1616 18.4633 22.5845 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.6185 18.4633 22.5845 0.02805 protocols.relax.FastRelax: {0} CMD: min -31.6405 18.4622 22.5831 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.6405 18.4622 22.5831 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1052 18.4622 22.5831 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 641 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.096 18.4622 22.5831 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.8169 18.4622 22.5831 0.154 protocols.relax.FastRelax: {0} CMD: min -26.823 18.4614 22.5822 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.823 18.4614 22.5822 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.6273 18.4614 22.5822 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 637 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.6274 18.4614 22.5822 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.2177 18.4614 22.5822 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.2214 18.4613 22.5823 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.2214 18.4613 22.5823 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.4211 18.4613 22.5823 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.4212 18.4613 22.5823 0.55 protocols.relax.FastRelax: {0} CMD: min -14.8805 18.49 22.6209 0.55 protocols.relax.FastRelax: {0} MRP: 4 -14.8805 -14.8823 18.4633 22.5845 protocols.relax.FastRelax: {0} CMD: accept_to_best -14.8805 18.49 22.6209 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -14.8805 18.49 22.6209 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_13.pdb protocols.relax.FastRelax: {0} CMD: repeat 16880.1 8.00504 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16880.1 8.00504 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1940.19 8.00504 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 602 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 54.2016 8.00504 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 56.9838 8.00504 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 56.8469 8.00682 0.00626248 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 56.8469 8.00682 0.00626248 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 110.431 8.00682 0.00626248 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 571 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 102.151 8.00682 0.00626248 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 105.229 8.00682 0.00626248 0.154 protocols.relax.FastRelax: {0} CMD: min -16.0475 8.52589 3.96488 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.0475 8.52589 3.96488 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.65459 8.52589 3.96488 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 587 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.8801 8.52589 3.96488 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.3203 8.52589 3.96488 0.31955 protocols.relax.FastRelax: {0} CMD: min -11.3467 8.52681 3.96546 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.3467 8.52681 3.96546 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -0.716613 8.52681 3.96546 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 578 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -0.716614 8.52681 3.96546 0.55 protocols.relax.FastRelax: {0} CMD: min -16.6471 8.09853 5.68962 0.55 protocols.relax.FastRelax: {0} MRP: 0 -16.6471 -16.6471 8.09853 5.68962 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.6471 8.09853 5.68962 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.6471 8.09853 5.68962 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.6471 8.09853 5.68962 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.4555 8.09853 5.68962 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.9693 8.09853 5.68962 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.6033 8.09853 5.68962 0.02805 protocols.relax.FastRelax: {0} CMD: min -29.658 8.10046 5.69172 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.658 8.10046 5.69172 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.6311 8.10046 5.69172 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.0423 8.10046 5.69172 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7914 8.10046 5.69172 0.154 protocols.relax.FastRelax: {0} CMD: min -25.808 8.10031 5.69402 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.808 8.10031 5.69402 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1376 8.10031 5.69402 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 589 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.1376 8.10031 5.69402 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7693 8.10031 5.69402 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.786 8.10077 5.6958 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.786 8.10077 5.6958 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.7785 8.10077 5.6958 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 581 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.7785 8.10077 5.6958 0.55 protocols.relax.FastRelax: {0} CMD: min -16.6642 8.10661 5.62588 0.55 protocols.relax.FastRelax: {0} MRP: 1 -16.6642 -16.6642 8.10661 5.62588 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.6642 8.10661 5.62588 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.6642 8.10661 5.62588 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.6642 8.10661 5.62588 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.508 8.10661 5.62588 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 627 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.0144 8.10661 5.62588 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.2248 8.10661 5.62588 0.02805 protocols.relax.FastRelax: {0} CMD: min -29.284 8.10838 5.62762 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.284 8.10838 5.62762 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.0255 8.10838 5.62762 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 597 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.0365 8.10838 5.62762 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7848 8.10838 5.62762 0.154 protocols.relax.FastRelax: {0} CMD: min -25.8013 8.10807 5.62994 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.8013 8.10807 5.62994 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1159 8.10807 5.62994 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 590 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.1159 8.10807 5.62994 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7464 8.10807 5.62994 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.7636 8.10839 5.63178 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.7636 8.10839 5.63178 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.7346 8.10839 5.63178 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 582 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.7346 8.10839 5.63178 0.55 protocols.relax.FastRelax: {0} CMD: min -16.6686 8.10475 5.59615 0.55 protocols.relax.FastRelax: {0} MRP: 2 -16.6686 -16.6686 8.10475 5.59615 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.6686 8.10475 5.59615 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.6686 8.10475 5.59615 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.6686 8.10475 5.59615 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.4927 8.10475 5.59615 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 626 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.0435 8.10475 5.59615 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.2617 8.10475 5.59615 0.02805 protocols.relax.FastRelax: {0} CMD: min -29.3205 8.10645 5.59788 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.3205 8.10645 5.59788 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.2099 8.10645 5.59788 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.0246 8.10645 5.59788 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7728 8.10645 5.59788 0.154 protocols.relax.FastRelax: {0} CMD: min -25.7894 8.10612 5.60017 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.7894 8.10612 5.60017 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.1014 8.10612 5.60017 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 589 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.1014 8.10612 5.60017 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.7317 8.10612 5.60017 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.7492 8.10643 5.602 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.7492 8.10643 5.602 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.7164 8.10643 5.602 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 582 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.7164 8.10643 5.602 0.55 protocols.relax.FastRelax: {0} CMD: min -16.6702 8.10513 5.58204 0.55 protocols.relax.FastRelax: {0} MRP: 3 -16.6702 -16.6702 8.10513 5.58204 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.6702 8.10513 5.58204 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.6702 8.10513 5.58204 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.6702 8.10513 5.58204 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.4949 8.10513 5.58204 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 626 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.0482 8.10513 5.58204 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.2683 8.10513 5.58204 0.02805 protocols.relax.FastRelax: {0} CMD: min -29.3263 8.10676 5.58375 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.3263 8.10676 5.58375 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.2484 8.10676 5.58375 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 596 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.0204 8.10676 5.58375 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.7682 8.10676 5.58375 0.154 protocols.relax.FastRelax: {0} CMD: min -25.7848 8.10642 5.58604 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.7848 8.10642 5.58604 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.0911 8.10642 5.58604 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 589 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.0911 8.10642 5.58604 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.721 8.10642 5.58604 0.31955 protocols.relax.FastRelax: {0} CMD: min -20.7388 8.10673 5.58788 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.7388 8.10673 5.58788 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -13.6975 8.10673 5.58788 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 581 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.6975 8.10673 5.58788 0.55 protocols.relax.FastRelax: {0} CMD: min -16.6708 8.10446 5.56659 0.55 protocols.relax.FastRelax: {0} MRP: 4 -16.6708 -16.6708 8.10446 5.56659 protocols.relax.FastRelax: {0} CMD: accept_to_best -16.6708 8.10446 5.56659 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -16.6708 8.10446 5.56659 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_2.pdb protocols.relax.FastRelax: {0} CMD: repeat 16092.5 8.22357 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16092.5 8.22357 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1980.08 8.22357 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 613 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 50.2907 8.22357 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 51.3311 8.22357 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 31.4033 8.5103 2.36226 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 31.4033 8.5103 2.36226 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 68.9983 8.5103 2.36226 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 594 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 39.1862 8.5103 2.36226 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 39.8996 8.5103 2.36226 0.154 protocols.relax.FastRelax: {0} CMD: min 39.69 8.51492 2.36227 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 39.69 8.51492 2.36227 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 52.92 8.51492 2.36227 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 586 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 52.7418 8.51492 2.36227 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 53.7607 8.51492 2.36227 0.31955 protocols.relax.FastRelax: {0} CMD: min -15.0338 8.95205 6.14432 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.0338 8.95205 6.14432 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.62245 8.95205 6.14432 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 606 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.8522 8.95205 6.14432 0.55 protocols.relax.FastRelax: {0} CMD: min -24.8356 9.03433 4.36158 0.55 protocols.relax.FastRelax: {0} MRP: 0 -24.8356 -24.8356 9.03433 4.36158 protocols.relax.FastRelax: {0} CMD: accept_to_best -24.8356 9.03433 4.36158 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -24.8356 9.03433 4.36158 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.8356 9.03433 4.36158 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -37.2422 9.03433 4.36158 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 702 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -41.8018 9.03433 4.36158 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.5224 9.03433 4.36158 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.4582 9.17299 5.68972 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.4582 9.17299 5.68972 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.492 9.17299 5.68972 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 699 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.6924 9.17299 5.68972 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.4681 9.17299 5.68972 0.154 protocols.relax.FastRelax: {0} CMD: min -42.934 9.1649 5.56205 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -42.934 9.1649 5.56205 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.2189 9.1649 5.56205 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 689 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.5324 9.1649 5.56205 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.8671 9.1649 5.56205 0.31955 protocols.relax.FastRelax: {0} CMD: min -34.5622 9.13355 5.50554 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.5622 9.13355 5.50554 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.4131 9.13355 5.50554 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.8675 9.13355 5.50554 0.55 protocols.relax.FastRelax: {0} CMD: min -34.8645 8.95653 4.92715 0.55 protocols.relax.FastRelax: {0} MRP: 1 -34.8645 -34.8645 8.95653 4.92715 protocols.relax.FastRelax: {0} CMD: accept_to_best -34.8645 8.95653 4.92715 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -34.8645 8.95653 4.92715 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.8645 8.95653 4.92715 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.4992 8.95653 4.92715 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 708 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.1604 8.95653 4.92715 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -47.9754 8.95653 4.92715 0.02805 protocols.relax.FastRelax: {0} CMD: min -56.2751 9.00052 5.47212 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -56.2751 9.00052 5.47212 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -36.6013 9.00052 5.47212 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 675 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -37.1668 9.00052 5.47212 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.8397 9.00052 5.47212 0.154 protocols.relax.FastRelax: {0} CMD: min -47.1324 8.89118 5.27686 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.1324 8.89118 5.27686 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.5366 8.89118 5.27686 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 664 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -39.5924 8.89118 5.27686 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.998 8.89118 5.27686 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.1417 8.88481 5.23796 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.1417 8.88481 5.23796 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.694 8.88481 5.23796 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.8016 8.88481 5.23796 0.55 protocols.relax.FastRelax: {0} CMD: min -36.0651 8.88583 4.82622 0.55 protocols.relax.FastRelax: {0} MRP: 2 -36.0651 -36.0651 8.88583 4.82622 protocols.relax.FastRelax: {0} CMD: accept_to_best -36.0651 8.88583 4.82622 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -36.0651 8.88583 4.82622 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -36.0651 8.88583 4.82622 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.4788 8.88583 4.82622 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 699 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -49.0418 8.88583 4.82622 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.7682 8.88583 4.82622 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.0949 9.00965 5.09582 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.0949 9.00965 5.09582 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.1563 9.00965 5.09582 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 683 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.083 9.00965 5.09582 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.2441 9.00965 5.09582 0.154 protocols.relax.FastRelax: {0} CMD: min -47.3649 8.90839 4.99776 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.3649 8.90839 4.99776 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.4087 8.90839 4.99776 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.6 8.90839 4.99776 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.0655 8.90839 4.99776 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.6769 8.87217 4.93805 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.6769 8.87217 4.93805 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.0306 8.87217 4.93805 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 652 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.0442 8.87217 4.93805 0.55 protocols.relax.FastRelax: {0} CMD: min -35.7361 8.89011 4.83153 0.55 protocols.relax.FastRelax: {0} MRP: 3 -35.7361 -36.0651 8.88583 4.82622 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.7361 8.89011 4.83153 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.7361 8.89011 4.83153 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.7361 8.89011 4.83153 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.4232 8.89011 4.83153 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 696 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -48.9863 8.89011 4.83153 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -48.7083 8.89011 4.83153 0.02805 protocols.relax.FastRelax: {0} CMD: min -54.1054 8.99872 5.08389 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -54.1054 8.99872 5.08389 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.7094 8.99872 5.08389 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 667 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.9279 8.99872 5.08389 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.1467 8.99872 5.08389 0.154 protocols.relax.FastRelax: {0} CMD: min -47.2482 8.89674 5.00861 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.2482 8.89674 5.00861 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -40.1557 8.89674 5.00861 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 659 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.3595 8.89674 5.00861 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.8145 8.89674 5.00861 0.31955 protocols.relax.FastRelax: {0} CMD: min -40.593 8.86097 4.92478 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.593 8.86097 4.92478 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -32.0237 8.86097 4.92478 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 653 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -32.0361 8.86097 4.92478 0.55 protocols.relax.FastRelax: {0} CMD: min -35.7368 8.88913 4.82976 0.55 protocols.relax.FastRelax: {0} MRP: 4 -35.7368 -36.0651 8.88583 4.82622 protocols.relax.FastRelax: {0} CMD: accept_to_best -35.7368 8.88913 4.82976 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -35.7368 8.88913 4.82976 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_36.pdb protocols.relax.FastRelax: {0} CMD: repeat 14258.5 5.6887 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14258.5 5.6887 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1938.55 5.6887 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 622 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 63.0482 5.6887 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 66.6501 5.6887 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -21.6403 6.17034 2.15683 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.6403 6.17034 2.15683 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 0.650242 6.17034 2.15683 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 617 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -2.42392 6.17034 2.15683 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.14733 6.17034 2.15683 0.154 protocols.relax.FastRelax: {0} CMD: min -17.0684 6.25712 2.53229 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.0684 6.25712 2.53229 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.4626 6.25712 2.53229 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 586 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.6067 6.25712 2.53229 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.93565 6.25712 2.53229 0.31955 protocols.relax.FastRelax: {0} CMD: min -11.3926 6.14861 2.49638 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.3926 6.14861 2.49638 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.0625 6.14861 2.49638 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 584 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -3.06819 6.14861 2.49638 0.55 protocols.relax.FastRelax: {0} CMD: min -8.85999 6.65695 3.37871 0.55 protocols.relax.FastRelax: {0} MRP: 0 -8.85999 -8.85999 6.65695 3.37871 protocols.relax.FastRelax: {0} CMD: accept_to_best -8.85999 6.65695 3.37871 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -8.85999 6.65695 3.37871 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -8.85999 6.65695 3.37871 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.7028 6.65695 3.37871 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 673 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.6228 6.65695 3.37871 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3991 6.65695 3.37871 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.3147 6.7668 3.56294 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.3147 6.7668 3.56294 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.3507 6.7668 3.56294 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 629 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.7005 6.7668 3.56294 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.3404 6.7668 3.56294 0.154 protocols.relax.FastRelax: {0} CMD: min -24.7326 6.65691 3.48733 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.7326 6.65691 3.48733 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.455 6.65691 3.48733 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 620 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7759 6.65691 3.48733 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.1607 6.65691 3.48733 0.31955 protocols.relax.FastRelax: {0} CMD: min -17.4048 6.6505 3.46862 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.4048 6.6505 3.46862 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.20603 6.6505 3.46862 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 588 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.47248 6.6505 3.46862 0.55 protocols.relax.FastRelax: {0} CMD: min -11.7611 6.55625 3.35437 0.55 protocols.relax.FastRelax: {0} MRP: 1 -11.7611 -11.7611 6.55625 3.35437 protocols.relax.FastRelax: {0} CMD: accept_to_best -11.7611 6.55625 3.35437 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -11.7611 6.55625 3.35437 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.7611 6.55625 3.35437 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5666 6.55625 3.35437 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1784 6.55625 3.35437 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.9526 6.55625 3.35437 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.1013 6.56298 3.35163 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.1013 6.56298 3.35163 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.459 6.56298 3.35163 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.9548 6.56298 3.35163 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.6958 6.56298 3.35163 0.154 protocols.relax.FastRelax: {0} CMD: min -24.5609 6.52379 3.30256 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.5609 6.52379 3.30256 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.8295 6.52379 3.30256 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 620 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.4313 6.52379 3.30256 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.8082 6.52379 3.30256 0.31955 protocols.relax.FastRelax: {0} CMD: min -16.077 6.5156 3.30169 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.077 6.5156 3.30169 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.6842 6.5156 3.30169 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 607 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -4.68578 6.5156 3.30169 0.55 protocols.relax.FastRelax: {0} CMD: min -11.8005 6.54431 3.34932 0.55 protocols.relax.FastRelax: {0} MRP: 2 -11.8005 -11.8005 6.54431 3.34932 protocols.relax.FastRelax: {0} CMD: accept_to_best -11.8005 6.54431 3.34932 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -11.8005 6.54431 3.34932 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.8005 6.54431 3.34932 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5776 6.54431 3.34932 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1766 6.54431 3.34932 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.9511 6.54431 3.34932 0.02805 protocols.relax.FastRelax: {0} CMD: min -33.4085 6.53017 3.38486 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4085 6.53017 3.38486 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.4517 6.53017 3.38486 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.5938 6.53017 3.38486 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.6244 6.53017 3.38486 0.154 protocols.relax.FastRelax: {0} CMD: min -24.2059 6.57333 3.35229 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.2059 6.57333 3.35229 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.3427 6.57333 3.35229 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.6092 6.57333 3.35229 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.9621 6.57333 3.35229 0.31955 protocols.relax.FastRelax: {0} CMD: min -18.1263 6.52617 3.3282 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.1263 6.52617 3.3282 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -10.1744 6.52617 3.3282 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -10.1745 6.52617 3.3282 0.55 protocols.relax.FastRelax: {0} CMD: min -11.8019 6.54326 3.35141 0.55 protocols.relax.FastRelax: {0} MRP: 3 -11.8019 -11.8019 6.54326 3.35141 protocols.relax.FastRelax: {0} CMD: accept_to_best -11.8019 6.54326 3.35141 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -11.8019 6.54326 3.35141 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -11.8019 6.54326 3.35141 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.5936 6.54326 3.35141 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 677 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.1906 6.54326 3.35141 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.9645 6.54326 3.35141 0.02805 protocols.relax.FastRelax: {0} CMD: min -33.4849 6.53148 3.38659 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -33.4849 6.53148 3.38659 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.1664 6.53148 3.38659 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 633 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.3057 6.53148 3.38659 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.3109 6.53148 3.38659 0.154 protocols.relax.FastRelax: {0} CMD: min -24.8268 6.55708 3.34394 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.8268 6.55708 3.34394 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.446 6.55708 3.34394 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 621 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.8844 6.55708 3.34394 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.2798 6.55708 3.34394 0.31955 protocols.relax.FastRelax: {0} CMD: min -17.5866 6.52758 3.33916 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.5866 6.52758 3.33916 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.83893 6.52758 3.33916 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.85134 6.52758 3.33916 0.55 protocols.relax.FastRelax: {0} CMD: min -11.8064 6.54225 3.35152 0.55 protocols.relax.FastRelax: {0} MRP: 4 -11.8064 -11.8064 6.54225 3.35152 protocols.relax.FastRelax: {0} CMD: accept_to_best -11.8064 6.54225 3.35152 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -11.8064 6.54225 3.35152 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_0.pdb protocols.relax.FastRelax: {0} CMD: repeat 14084.3 5.31796 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14084.3 5.31796 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2267.32 5.31796 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 639 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 64.4213 5.31796 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 68.0917 5.31796 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 42.3775 5.20094 1.61667 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 42.3775 5.20094 1.61667 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 94.5014 5.20094 1.61667 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 570 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 57.1387 5.20094 1.61667 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 58.343 5.20094 1.61667 0.154 protocols.relax.FastRelax: {0} CMD: min -5.39499 7.88237 6.50118 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -5.39499 7.88237 6.50118 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.20612 7.88237 6.50118 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 599 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 1.062 7.88237 6.50118 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 1.6225 7.88237 6.50118 0.31955 protocols.relax.FastRelax: {0} CMD: min -5.52714 9.87503 8.93616 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -5.52714 9.87503 8.93616 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.02616 9.87503 8.93616 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 601 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 0.480936 9.87503 8.93616 0.55 protocols.relax.FastRelax: {0} CMD: min -9.13554 10.0236 9.07356 0.55 protocols.relax.FastRelax: {0} MRP: 0 -9.13554 -9.13554 10.0236 9.07356 protocols.relax.FastRelax: {0} CMD: accept_to_best -9.13554 10.0236 9.07356 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -9.13554 10.0236 9.07356 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -9.13554 10.0236 9.07356 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.0783 10.0236 9.07356 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 664 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.2204 10.0236 9.07356 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.956 10.0236 9.07356 0.02805 protocols.relax.FastRelax: {0} CMD: min -27.2371 9.82105 8.83117 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.2371 9.82105 8.83117 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.03242 9.82105 8.83117 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 697 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.78933 9.82105 8.83117 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.58542 9.82105 8.83117 0.154 protocols.relax.FastRelax: {0} CMD: min -21.4338 9.96163 9.0156 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.4338 9.96163 9.0156 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.1418 9.96163 9.0156 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 630 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.1719 9.96163 9.0156 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.678 9.96163 9.0156 0.31955 protocols.relax.FastRelax: {0} CMD: min -14.9838 9.98719 9.04428 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.9838 9.98719 9.04428 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.14143 9.98719 9.04428 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 625 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -6.18448 9.98719 9.04428 0.55 protocols.relax.FastRelax: {0} CMD: min -15.0527 10.4884 9.65999 0.55 protocols.relax.FastRelax: {0} MRP: 1 -15.0527 -15.0527 10.4884 9.65999 protocols.relax.FastRelax: {0} CMD: accept_to_best -15.0527 10.4884 9.65999 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -15.0527 10.4884 9.65999 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.0527 10.4884 9.65999 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.2527 10.4884 9.65999 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 812 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.1276 10.4884 9.65999 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.8767 10.4884 9.65999 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.6625 10.5302 9.73849 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.6625 10.5302 9.73849 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5803 10.5302 9.73849 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 864 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.1797 10.5302 9.73849 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.4136 10.5302 9.73849 0.154 protocols.relax.FastRelax: {0} CMD: min -29.2091 10.299 9.48105 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -29.2091 10.299 9.48105 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.2524 10.299 9.48105 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 833 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.2738 10.299 9.48105 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.7273 10.299 9.48105 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.8663 10.3094 9.49346 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.8663 10.3094 9.49346 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.6927 10.3094 9.49346 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 792 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -11.8777 10.3094 9.49346 0.55 protocols.relax.FastRelax: {0} CMD: min -19.6511 9.40149 8.34333 0.55 protocols.relax.FastRelax: {0} MRP: 2 -19.6511 -19.6511 9.40149 8.34333 protocols.relax.FastRelax: {0} CMD: accept_to_best -19.6511 9.40149 8.34333 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -19.6511 9.40149 8.34333 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.6511 9.40149 8.34333 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.1684 9.40149 8.34333 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 904 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -34.3839 9.40149 8.34333 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.723 9.40149 8.34333 0.02805 protocols.relax.FastRelax: {0} CMD: min -41.998 9.56214 8.57722 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.998 9.56214 8.57722 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7475 9.56214 8.57722 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 886 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -21.837 9.56214 8.57722 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -20.5487 9.56214 8.57722 0.154 protocols.relax.FastRelax: {0} CMD: min -32.9442 9.43468 8.4136 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.9442 9.43468 8.4136 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2521 9.43468 8.4136 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 758 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.2558 9.43468 8.4136 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.6508 9.43468 8.4136 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.1242 9.44081 8.41781 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.1242 9.44081 8.41781 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.3672 9.44081 8.41781 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 719 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.5063 9.44081 8.41781 0.55 protocols.relax.FastRelax: {0} CMD: min -20.6964 9.30078 8.1969 0.55 protocols.relax.FastRelax: {0} MRP: 3 -20.6964 -20.6964 9.30078 8.1969 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.6964 9.30078 8.1969 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.6964 9.30078 8.1969 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -20.6964 9.30078 8.1969 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.5492 9.30078 8.1969 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 791 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.6324 9.30078 8.1969 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.9623 9.30078 8.1969 0.02805 protocols.relax.FastRelax: {0} CMD: min -38.4091 9.42 8.37952 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -38.4091 9.42 8.37952 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.4168 9.42 8.37952 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 855 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.9004 9.42 8.37952 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.1369 9.42 8.37952 0.154 protocols.relax.FastRelax: {0} CMD: min -32.1988 9.39661 8.32953 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.1988 9.39661 8.32953 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.8508 9.39661 8.32953 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 755 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.9323 9.39661 8.32953 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.4412 9.39661 8.32953 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.8836 9.40197 8.33344 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.8836 9.40197 8.33344 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.2548 9.40197 8.33344 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 706 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.271 9.40197 8.33344 0.55 protocols.relax.FastRelax: {0} CMD: min -20.7745 9.29643 8.18653 0.55 protocols.relax.FastRelax: {0} MRP: 4 -20.7745 -20.7745 9.29643 8.18653 protocols.relax.FastRelax: {0} CMD: accept_to_best -20.7745 9.29643 8.18653 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -20.7745 9.29643 8.18653 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_41.pdb protocols.relax.FastRelax: {0} CMD: repeat 16069.5 8.43767 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 16069.5 8.43767 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2069.84 8.43767 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 632 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 100.5 8.43767 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 113.644 8.43767 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -18.7319 10.136 6.13807 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.7319 10.136 6.13807 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 8.19352 10.136 6.13807 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 652 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 5.93072 10.136 6.13807 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 7.7696 10.136 6.13807 0.154 protocols.relax.FastRelax: {0} CMD: min -18.1199 8.92187 5.64819 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.1199 8.92187 5.64819 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -9.80326 8.92187 5.64819 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.0221 8.92187 5.64819 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.3061 8.92187 5.64819 0.31955 protocols.relax.FastRelax: {0} CMD: min -19.3907 8.71445 6.34154 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -19.3907 8.71445 6.34154 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.978 8.71445 6.34154 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 617 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.2433 8.71445 6.34154 0.55 protocols.relax.FastRelax: {0} CMD: min -17.2352 7.76336 5.13682 0.55 protocols.relax.FastRelax: {0} MRP: 0 -17.2352 -17.2352 7.76336 5.13682 protocols.relax.FastRelax: {0} CMD: accept_to_best -17.2352 7.76336 5.13682 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -17.2352 7.76336 5.13682 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -17.2352 7.76336 5.13682 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.9966 7.76336 5.13682 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 643 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.708 7.76336 5.13682 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.533 7.76336 5.13682 0.02805 protocols.relax.FastRelax: {0} CMD: min -34.4237 7.85069 5.20119 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.4237 7.85069 5.20119 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.6584 7.85069 5.20119 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 619 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.8143 7.85069 5.20119 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.34 7.85069 5.20119 0.154 protocols.relax.FastRelax: {0} CMD: min -27.4788 7.84934 5.20322 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -27.4788 7.84934 5.20322 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.895 7.84934 5.20322 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 608 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.8723 7.84934 5.20322 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.3346 7.84934 5.20322 0.31955 protocols.relax.FastRelax: {0} CMD: min -21.7201 7.867 5.26965 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.7201 7.867 5.26965 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.6212 7.867 5.26965 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -14.6887 7.867 5.26965 0.55 protocols.relax.FastRelax: {0} CMD: min -18.0589 7.97258 5.17243 0.55 protocols.relax.FastRelax: {0} MRP: 1 -18.0589 -18.0589 7.97258 5.17243 protocols.relax.FastRelax: {0} CMD: accept_to_best -18.0589 7.97258 5.17243 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -18.0589 7.97258 5.17243 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.0589 7.97258 5.17243 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.9102 7.97258 5.17243 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.6089 7.97258 5.17243 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.4151 7.97258 5.17243 0.02805 protocols.relax.FastRelax: {0} CMD: min -35.8712 7.90262 5.23429 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -35.8712 7.90262 5.23429 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.2482 7.90262 5.23429 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 634 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.7262 7.90262 5.23429 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.0816 7.90262 5.23429 0.154 protocols.relax.FastRelax: {0} CMD: min -30.1416 7.83094 5.38596 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.1416 7.83094 5.38596 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.0791 7.83094 5.38596 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 606 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -23.1521 7.83094 5.38596 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.5953 7.83094 5.38596 0.31955 protocols.relax.FastRelax: {0} CMD: min -23.9399 7.81749 5.42235 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -23.9399 7.81749 5.42235 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.3174 7.81749 5.42235 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 599 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.3174 7.81749 5.42235 0.55 protocols.relax.FastRelax: {0} CMD: min -21.5406 7.9128 5.92056 0.55 protocols.relax.FastRelax: {0} MRP: 2 -21.5406 -21.5406 7.9128 5.92056 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.5406 7.9128 5.92056 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.5406 7.9128 5.92056 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.5406 7.9128 5.92056 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.8528 7.9128 5.92056 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 678 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.4439 7.9128 5.92056 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.2582 7.9128 5.92056 0.02805 protocols.relax.FastRelax: {0} CMD: min -41.2998 8.0039 5.85023 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -41.2998 8.0039 5.85023 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.7063 8.0039 5.85023 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 624 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.0949 8.0039 5.85023 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -26.2251 8.0039 5.85023 0.154 protocols.relax.FastRelax: {0} CMD: min -32.2379 7.96985 5.84307 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.2379 7.96985 5.84307 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.8688 7.96985 5.84307 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 618 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.8923 7.96985 5.84307 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.3194 7.96985 5.84307 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.0766 7.95469 5.85949 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.0766 7.95469 5.85949 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.9076 7.95469 5.85949 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 610 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.9076 7.95469 5.85949 0.55 protocols.relax.FastRelax: {0} CMD: min -21.134 7.85211 5.66634 0.55 protocols.relax.FastRelax: {0} MRP: 3 -21.134 -21.5406 7.9128 5.92056 protocols.relax.FastRelax: {0} CMD: accept_to_best -21.134 7.85211 5.66634 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -21.134 7.85211 5.66634 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.134 7.85211 5.66634 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -34.6099 7.85211 5.66634 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 676 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -36.1629 7.85211 5.66634 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.8376 7.85211 5.66634 0.02805 protocols.relax.FastRelax: {0} CMD: min -40.2103 7.84265 5.71217 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.2103 7.84265 5.71217 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.158 7.84265 5.71217 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 622 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.6988 7.84265 5.71217 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.0259 7.84265 5.71217 0.154 protocols.relax.FastRelax: {0} CMD: min -32.7432 7.84182 5.72476 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.7432 7.84182 5.72476 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.7413 7.84182 5.72476 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 613 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -24.7966 7.84182 5.72476 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.1769 7.84182 5.72476 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.9244 7.82047 5.73843 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.9244 7.82047 5.73843 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.2871 7.82047 5.73843 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 604 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.2882 7.82047 5.73843 0.55 protocols.relax.FastRelax: {0} CMD: min -22.0502 7.84971 5.65448 0.55 protocols.relax.FastRelax: {0} MRP: 4 -22.0502 -22.0502 7.84971 5.65448 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.0502 7.84971 5.65448 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.0502 7.84971 5.65448 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_16.pdb protocols.relax.FastRelax: {0} CMD: repeat 15214.7 6.60983 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 15214.7 6.60983 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2487.43 6.60983 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 695 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 91.3799 6.60983 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 99.049 6.60983 0 0.02805 protocols.relax.FastRelax: {0} CMD: min -12.1053 7.19244 5.77919 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -12.1053 7.19244 5.77919 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 15.083 7.19244 5.77919 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 703 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 1.07923 7.19244 5.77919 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2.35809 7.19244 5.77919 0.154 protocols.relax.FastRelax: {0} CMD: min -15.8682 7.24944 5.91065 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -15.8682 7.24944 5.91065 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.53444 7.24944 5.91065 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 673 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -7.10523 7.24944 5.91065 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.37542 7.24944 5.91065 0.31955 protocols.relax.FastRelax: {0} CMD: min -7.4871 7.22459 5.86522 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -7.4871 7.22459 5.86522 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 3.68512 7.22459 5.86522 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 3.68437 7.22459 5.86522 0.55 protocols.relax.FastRelax: {0} CMD: min -4.91223 7.38442 6.56804 0.55 protocols.relax.FastRelax: {0} MRP: 0 -4.91223 -4.91223 7.38442 6.56804 protocols.relax.FastRelax: {0} CMD: accept_to_best -4.91223 7.38442 6.56804 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -4.91223 7.38442 6.56804 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -4.91223 7.38442 6.56804 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.4307 7.38442 6.56804 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 715 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.029 7.38442 6.56804 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -21.6768 7.38442 6.56804 0.02805 protocols.relax.FastRelax: {0} CMD: min -31.2136 7.7855 7.19772 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.2136 7.7855 7.19772 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -6.85565 7.7855 7.19772 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 680 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -9.26103 7.7855 7.19772 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -7.79579 7.7855 7.19772 0.154 protocols.relax.FastRelax: {0} CMD: min -24.233 7.83367 7.25037 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.233 7.83367 7.25037 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.0011 7.83367 7.25037 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.1192 7.83367 7.25037 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -14.3902 7.83367 7.25037 0.31955 protocols.relax.FastRelax: {0} CMD: min -14.8536 7.828 7.24023 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -14.8536 7.828 7.24023 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -1.69784 7.828 7.24023 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 670 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -1.7008 7.828 7.24023 0.55 protocols.relax.FastRelax: {0} CMD: min -10.8315 7.82347 7.24542 0.55 protocols.relax.FastRelax: {0} MRP: 1 -10.8315 -10.8315 7.82347 7.24542 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.8315 7.82347 7.24542 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.8315 7.82347 7.24542 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.8315 7.82347 7.24542 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.1569 7.82347 7.24542 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 735 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -27.6144 7.82347 7.24542 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.4008 7.82347 7.24542 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.2411 8.16501 7.89546 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.2411 8.16501 7.89546 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.6277 8.16501 7.89546 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 703 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -18.9178 8.16501 7.89546 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -17.6531 8.16501 7.89546 0.154 protocols.relax.FastRelax: {0} CMD: min -26.3135 8.0289 7.63418 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.3135 8.0289 7.63418 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.7571 8.0289 7.63418 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 698 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.7573 8.0289 7.63418 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.0037 8.0289 7.63418 0.31955 protocols.relax.FastRelax: {0} CMD: min -18.5971 7.94478 7.47329 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.5971 7.94478 7.47329 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.77212 7.94478 7.47329 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.77676 7.94478 7.47329 0.55 protocols.relax.FastRelax: {0} CMD: min -10.8972 7.74671 7.07784 0.55 protocols.relax.FastRelax: {0} MRP: 2 -10.8972 -10.8972 7.74671 7.07784 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.8972 7.74671 7.07784 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.8972 7.74671 7.07784 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.8972 7.74671 7.07784 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.6842 7.74671 7.07784 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 727 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.1211 7.74671 7.07784 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.902 7.74671 7.07784 0.02805 protocols.relax.FastRelax: {0} CMD: min -37.2651 8.10293 7.77676 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -37.2651 8.10293 7.77676 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.3041 8.10293 7.77676 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 700 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -17.6574 8.10293 7.77676 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.2979 8.10293 7.77676 0.154 protocols.relax.FastRelax: {0} CMD: min -26.5038 7.99499 7.54656 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -26.5038 7.99499 7.54656 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.9765 7.99499 7.54656 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 695 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.9808 7.99499 7.54656 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.2319 7.99499 7.54656 0.31955 protocols.relax.FastRelax: {0} CMD: min -16.8736 7.96545 7.47142 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -16.8736 7.96545 7.47142 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -4.14919 7.96545 7.47142 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -4.16399 7.96545 7.47142 0.55 protocols.relax.FastRelax: {0} CMD: min -10.8934 7.74381 7.07715 0.55 protocols.relax.FastRelax: {0} MRP: 3 -10.8934 -10.8972 7.74671 7.07784 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.8934 7.74381 7.07715 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.8934 7.74381 7.07715 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -10.8934 7.74381 7.07715 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.674 7.74381 7.07715 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 726 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -28.1215 7.74381 7.07715 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -27.9023 7.74381 7.07715 0.02805 protocols.relax.FastRelax: {0} CMD: min -31.2105 7.84642 7.35285 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -31.2105 7.84642 7.35285 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -18.4832 7.84642 7.35285 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 716 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -20.6488 7.84642 7.35285 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.8791 7.84642 7.35285 0.154 protocols.relax.FastRelax: {0} CMD: min -24.396 7.86294 7.30912 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -24.396 7.86294 7.30912 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.4805 7.86294 7.30912 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 693 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -15.7085 7.86294 7.30912 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -15.0043 7.86294 7.30912 0.31955 protocols.relax.FastRelax: {0} CMD: min -18.1393 7.83399 7.20924 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.1393 7.83399 7.20924 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -8.75668 7.83399 7.20924 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -8.76251 7.83399 7.20924 0.55 protocols.relax.FastRelax: {0} CMD: min -10.9037 7.73882 7.06792 0.55 protocols.relax.FastRelax: {0} MRP: 4 -10.9037 -10.9037 7.73882 7.06792 protocols.relax.FastRelax: {0} CMD: accept_to_best -10.9037 7.73882 7.06792 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -10.9037 7.73882 7.06792 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax Working on decoy: outputs/random/decoy_28.pdb protocols.relax.FastRelax: {0} CMD: repeat 14909.6 5.2511 0 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 14909.6 5.2511 0 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 2276.77 5.2511 0 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 589 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 69.9648 5.2511 0 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 75.7873 5.2511 0 0.02805 protocols.relax.FastRelax: {0} CMD: min 8.92555 6.97979 8.94594 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight 8.92555 6.97979 8.94594 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 155.579 6.97979 8.94594 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 656 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack 8.7689 6.97979 8.94594 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep 10.6242 6.97979 8.94594 0.154 protocols.relax.FastRelax: {0} CMD: min -21.717 6.31672 8.06875 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -21.717 6.31672 8.06875 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.5026 6.31672 8.06875 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 635 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.8428 6.31672 8.06875 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.1234 6.31672 8.06875 0.31955 protocols.relax.FastRelax: {0} CMD: min -13.9224 6.32076 8.05597 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -13.9224 6.32076 8.05597 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -3.87683 6.32076 8.05597 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 636 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -3.67985 6.32076 8.05597 0.55 protocols.relax.FastRelax: {0} CMD: min -18.7185 8.21549 9.9897 0.55 protocols.relax.FastRelax: {0} MRP: 0 -18.7185 -18.7185 8.21549 9.9897 protocols.relax.FastRelax: {0} CMD: accept_to_best -18.7185 8.21549 9.9897 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -18.7185 8.21549 9.9897 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -18.7185 8.21549 9.9897 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -33.9221 8.21549 9.9897 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -35.8714 8.21549 9.9897 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -35.44 8.21549 9.9897 0.02805 protocols.relax.FastRelax: {0} CMD: min -47.1312 8.34459 10.2019 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -47.1312 8.34459 10.2019 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.0208 8.34459 10.2019 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 651 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.2635 8.34459 10.2019 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.9255 8.34459 10.2019 0.154 protocols.relax.FastRelax: {0} CMD: min -34.5635 8.45697 10.2564 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -34.5635 8.45697 10.2564 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.6654 8.45697 10.2564 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 669 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.6654 8.45697 10.2564 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.9638 8.45697 10.2564 0.31955 protocols.relax.FastRelax: {0} CMD: min -25.4713 8.42376 10.211 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.4713 8.42376 10.211 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -12.9102 8.42376 10.211 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 662 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -12.9133 8.42376 10.211 0.55 protocols.relax.FastRelax: {0} CMD: min -22.7653 8.95125 10.5149 0.55 protocols.relax.FastRelax: {0} MRP: 1 -22.7653 -22.7653 8.95125 10.5149 protocols.relax.FastRelax: {0} CMD: accept_to_best -22.7653 8.95125 10.5149 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -22.7653 8.95125 10.5149 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -22.7653 8.95125 10.5149 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -38.0965 8.95125 10.5149 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 688 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -40.2755 8.95125 10.5149 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -39.5853 8.95125 10.5149 0.02805 protocols.relax.FastRelax: {0} CMD: min -45.2772 8.95467 10.5239 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -45.2772 8.95467 10.5239 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.0195 8.95467 10.5239 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 679 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -13.9492 8.95467 10.5239 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -11.803 8.95467 10.5239 0.154 protocols.relax.FastRelax: {0} CMD: min -39.0851 8.98017 10.5592 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.0851 8.98017 10.5592 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -31.051 8.98017 10.5592 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 668 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -31.0586 8.98017 10.5592 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.4257 8.98017 10.5592 0.31955 protocols.relax.FastRelax: {0} CMD: min -30.8194 8.97954 10.5575 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.8194 8.97954 10.5575 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -19.3361 8.97954 10.5575 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 658 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -19.3376 8.97954 10.5575 0.55 protocols.relax.FastRelax: {0} CMD: min -25.7363 8.91822 10.4836 0.55 protocols.relax.FastRelax: {0} MRP: 2 -25.7363 -25.7363 8.91822 10.4836 protocols.relax.FastRelax: {0} CMD: accept_to_best -25.7363 8.91822 10.4836 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -25.7363 8.91822 10.4836 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.7363 8.91822 10.4836 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.6226 8.91822 10.4836 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 683 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.9108 8.91822 10.4836 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.539 8.91822 10.4836 0.02805 protocols.relax.FastRelax: {0} CMD: min -49.5888 9.00954 10.5785 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -49.5888 9.00954 10.5785 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.2588 9.00954 10.5785 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 672 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -26.7271 9.00954 10.5785 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -25.1776 9.00954 10.5785 0.154 protocols.relax.FastRelax: {0} CMD: min -39.304 8.95942 10.5504 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -39.304 8.95942 10.5504 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -29.5621 8.95942 10.5504 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -29.5623 8.95942 10.5504 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -28.7941 8.95942 10.5504 0.31955 protocols.relax.FastRelax: {0} CMD: min -32.1425 8.96291 10.5534 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -32.1425 8.96291 10.5534 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -22.0725 8.96291 10.5534 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 660 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -22.0731 8.96291 10.5534 0.55 protocols.relax.FastRelax: {0} CMD: min -25.7374 8.92187 10.4853 0.55 protocols.relax.FastRelax: {0} MRP: 3 -25.7374 -25.7374 8.92187 10.4853 protocols.relax.FastRelax: {0} CMD: accept_to_best -25.7374 8.92187 10.4853 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -25.7374 8.92187 10.4853 0.55 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -25.7374 8.92187 10.4853 0.55 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -41.6181 8.92187 10.4853 0.022 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 683 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -42.9412 8.92187 10.4853 0.022 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -42.5731 8.92187 10.4853 0.02805 protocols.relax.FastRelax: {0} CMD: min -52.4518 9.17264 10.7754 0.02805 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -52.4518 9.17264 10.7754 0.02805 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -24.1735 9.17264 10.7754 0.14575 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 673 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -25.3783 9.17264 10.7754 0.14575 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -23.5531 9.17264 10.7754 0.154 protocols.relax.FastRelax: {0} CMD: min -40.3612 9.0718 10.6697 0.154 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -40.3612 9.0718 10.6697 0.154 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.7705 9.0718 10.6697 0.30745 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 666 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -30.7708 9.0718 10.6697 0.30745 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -30.0147 9.0718 10.6697 0.31955 protocols.relax.FastRelax: {0} CMD: min -30.3885 9.05803 10.6499 0.31955 protocols.relax.FastRelax: {0} CMD: coord_cst_weight -30.3885 9.05803 10.6499 0.31955 protocols.relax.FastRelax: {0} CMD: scale:fa_rep -16.6698 9.05803 10.6499 0.55 core.pack.task: {0} Packer task: initialize from command line() core.pack.pack_rotamers: {0} built 661 rotamers at 50 positions. core.pack.pack_rotamers: {0} Requesting all available threads for interaction graph computation. core.pack.interaction_graph.interaction_graph_factory: {0} Instantiating DensePDInteractionGraph core.pack.rotamer_set.RotamerSets: {0} Completed interaction graph pre-calculation in 8 available threads (8 had been requested). protocols.relax.FastRelax: {0} CMD: repack -16.6713 9.05803 10.6499 0.55 protocols.relax.FastRelax: {0} CMD: min -25.7374 8.92671 10.4892 0.55 protocols.relax.FastRelax: {0} MRP: 4 -25.7374 -25.7374 8.92187 10.4853 protocols.relax.FastRelax: {0} CMD: accept_to_best -25.7374 8.92671 10.4892 0.55 protocols.relax.FastRelax: {0} CMD: endrepeat -25.7374 8.92671 10.4892 0.55 protocols::checkpoint: {0} Deleting checkpoints of FastRelax
decoy_poses = [prs.pose_from_pdb(f) for f in glob.glob(job_output + '*.pdb')]
core.import_pose.import_pose: {0} File 'outputs/random/decoy_41.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_1.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_37.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_13.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_5.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_33.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_39.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_9.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_47.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_11.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_32.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_26.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_4.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_49.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_40.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_10.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_43.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_35.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_21.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_14.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_7.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_6.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_2.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_24.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_8.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_42.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_20.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_17.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_25.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_22.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_44.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_34.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_45.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_3.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_23.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_38.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_16.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_18.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_28.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_48.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_15.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_46.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_30.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_19.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_27.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_0.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_36.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_29.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_31.pdb' automatically determined to be of type PDB core.import_pose.import_pose: {0} File 'outputs/random/decoy_12.pdb' automatically determined to be of type PDB
data = []
for i in range(1, len(decoy_poses)): # print out the job scores
data.append({'structure': decoy_poses[i].pdb_info().name(),
'energy_score': scores[i]})
df = pd.DataFrame(data)
df.sort_values('energy_score')
energy_score | structure | |
---|---|---|
27 | -53.142294 | outputs/random/decoy_25.pdb |
30 | -43.733361 | outputs/random/decoy_34.pdb |
17 | -41.937664 | outputs/random/decoy_21.pdb |
32 | -40.823222 | outputs/random/decoy_3.pdb |
11 | -37.932157 | outputs/random/decoy_4.pdb |
44 | -36.065080 | outputs/random/decoy_0.pdb |
33 | -35.992126 | outputs/random/decoy_23.pdb |
7 | -35.778544 | outputs/random/decoy_47.pdb |
20 | -35.560202 | outputs/random/decoy_6.pdb |
4 | -35.254630 | outputs/random/decoy_33.pdb |
3 | -33.489562 | outputs/random/decoy_5.pdb |
13 | -32.656341 | outputs/random/decoy_40.pdb |
18 | -32.326720 | outputs/random/decoy_14.pdb |
41 | -31.407290 | outputs/random/decoy_30.pdb |
37 | -30.317749 | outputs/random/decoy_28.pdb |
39 | -29.727147 | outputs/random/decoy_15.pdb |
26 | -28.268543 | outputs/random/decoy_17.pdb |
8 | -28.057287 | outputs/random/decoy_11.pdb |
38 | -27.768231 | outputs/random/decoy_48.pdb |
16 | -26.316974 | outputs/random/decoy_35.pdb |
9 | -24.760832 | outputs/random/decoy_32.pdb |
19 | -23.458524 | outputs/random/decoy_7.pdb |
36 | -22.270473 | outputs/random/decoy_18.pdb |
28 | -22.057972 | outputs/random/decoy_22.pdb |
47 | -22.050172 | outputs/random/decoy_31.pdb |
15 | -21.305154 | outputs/random/decoy_43.pdb |
24 | -21.269224 | outputs/random/decoy_42.pdb |
34 | -20.997539 | outputs/random/decoy_38.pdb |
46 | -20.774485 | outputs/random/decoy_29.pdb |
10 | -20.220729 | outputs/random/decoy_26.pdb |
31 | -20.105875 | outputs/random/decoy_45.pdb |
2 | -19.838025 | outputs/random/decoy_13.pdb |
23 | -19.291712 | outputs/random/decoy_8.pdb |
25 | -17.692451 | outputs/random/decoy_20.pdb |
12 | -17.640500 | outputs/random/decoy_49.pdb |
43 | -16.670767 | outputs/random/decoy_27.pdb |
6 | -16.458693 | outputs/random/decoy_9.pdb |
1 | -15.520654 | outputs/random/decoy_37.pdb |
42 | -14.882271 | outputs/random/decoy_19.pdb |
40 | -14.865020 | outputs/random/decoy_46.pdb |
22 | -13.519384 | outputs/random/decoy_24.pdb |
0 | -13.025488 | outputs/random/decoy_1.pdb |
5 | -12.539581 | outputs/random/decoy_39.pdb |
45 | -11.806401 | outputs/random/decoy_36.pdb |
48 | -10.903713 | outputs/random/decoy_12.pdb |
21 | -9.384103 | outputs/random/decoy_2.pdb |
35 | -6.933988 | outputs/random/decoy_16.pdb |
29 | -2.476696 | outputs/random/decoy_44.pdb |
14 | 3.789485 | outputs/random/decoy_10.pdb |
import matplotlib.pyplot as plt
plt.scatter(rmsd_df["energy_score"], rmsd_df["rmsd"])
plt.xlabel("energy_score")
plt.ylabel("rmsd")
plt.show()