data_1qvl_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1qvl _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 52.8 mtp85 -75.51 -24.86 56.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.522 1.129 . . . . 0.0 112.236 -172.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -172.27 178.95 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.605 2.762 . . . . 0.0 110.242 -169.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.6 t90 46.5 -132.33 1.14 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.741 2.016 . . . . 0.0 113.403 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -78.79 -12.02 60.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.206 1.402 . . . . 0.0 112.857 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . 0.259 95.1 m-85 . . . . . 0 C--N 1.345 0.38 0 C-N-CA 126.351 1.86 . . . . 0.0 112.221 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.2 mtp85 -70.7 -27.1 63.74 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.22 1.008 . . . . 0.0 112.063 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.7 173.32 5.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.09 2.156 . . . . 0.0 110.39 -169.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.0 t90 46.47 -125.15 1.43 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.313 1.845 . . . . 0.0 113.71 169.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -78.53 -15.61 58.39 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 125.456 1.503 . . . . 0.0 113.349 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 CA--C 1.538 0.488 0 C-N-CA 125.807 1.643 . . . . 0.0 112.176 -175.628 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.2 mtm-85 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.4 mtm-85 -73.67 -31.03 63.25 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.248 1.019 . . . . 0.0 112.277 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.09 172.03 10.45 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.575 1.95 . . . . 0.0 110.515 -169.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.7 t90 50.95 -137.77 1.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.936 1.694 . . . . 0.0 112.036 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -74.46 -17.84 60.72 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.893 1.277 . . . . 0.0 112.025 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 126.767 2.027 . . . . 0.0 112.106 -177.57 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 mtm180 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -79.97 -23.97 41.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.133 1.373 . . . . 0.0 112.097 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -168.98 177.44 4.93 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.116 2.166 . . . . 0.0 110.634 -171.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.6 t90 47.67 -132.76 1.32 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.618 1.967 . . . . 0.0 113.068 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -76.84 -14.16 59.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.257 1.423 . . . . 0.0 112.562 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 126.424 1.89 . . . . 0.0 113.096 -172.004 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.63 -32.79 68.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.157 1.383 . . . . 0.0 112.409 -172.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.4 -176.29 3.18 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.399 1.88 . . . . 0.0 111.016 -168.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.3 t90 50.48 -130.15 2.13 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.233 1.813 . . . . 0.0 111.846 169.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -79.66 -16.1 56.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.914 1.286 . . . . 0.0 112.758 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 126.763 2.025 . . . . 0.0 113.577 -169.777 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.5 mtp85 . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -81.42 -42.56 20.21 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.041 1.737 . . . . 0.0 110.828 -171.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.15 177.49 11.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.364 2.266 . . . . 0.0 110.895 -170.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.0 t90 50.12 -131.03 1.98 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.566 1.546 . . . . 0.0 112.12 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.11 -22.0 56.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.263 1.425 . . . . 0.0 112.21 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.528 0 C-N-CA 126.499 1.919 . . . . 0.0 113.082 -171.149 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -77.05 -27.71 54.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.47 1.108 . . . . 0.0 111.705 -173.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.78 -178.64 2.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.683 2.793 . . . . 0.0 109.983 -169.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.4 t90 46.44 -133.54 1.01 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.998 2.119 . . . . 0.0 113.553 169.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.7 -18.23 61.56 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.434 1.493 . . . . 0.0 112.455 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 125.896 1.678 . . . . 0.0 112.428 -169.585 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.75 -23.78 58.6 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.499 0.72 . . . . 0.0 112.712 -174.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -158.64 174.32 15.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.809 1.244 . . . . 0.0 110.773 -170.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.2 t90 45.69 -126.78 1.28 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.72 2.008 . . . . 0.0 113.32 169.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.5 mtt-85 -79.18 -16.53 56.46 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.92 1.688 . . . . 0.0 112.96 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.538 0.514 0 C-N-CA 126.187 1.795 . . . . 0.0 112.38 -172.496 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 mtp85 -84.91 -26.19 27.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.535 1.534 . . . . 0.0 111.63 -169.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -162.41 169.55 20.27 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 125.672 1.589 . . . . 0.0 110.399 -169.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 2.1 t90 47.25 -132.11 1.3 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.546 1.938 . . . . 0.0 111.562 -174.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -82.66 -14.78 54.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.063 1.345 . . . . 0.0 112.745 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 . . . . . 0 N--CA 1.449 -0.481 0 C-N-CA 126.57 1.948 . . . . 0.0 111.716 -179.41 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -63.43 -45.34 91.38 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.653 1.581 . . . . 0.0 111.859 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -163.29 -177.88 5.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 128.877 2.871 . . . . 0.0 110.526 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.1 t90 47.13 -130.11 1.48 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.618 1.967 . . . . 0.0 113.464 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -74.04 -17.86 60.92 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.499 1.52 . . . . 0.0 112.526 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.586 1.954 . . . . 0.0 112.415 -172.566 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 52.8 mtp85 -75.51 -24.86 56.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.522 1.129 . . . . 0.0 112.236 -172.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -172.27 178.95 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.605 2.762 . . . . 0.0 110.242 -169.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.6 t90 46.5 -132.33 1.14 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.741 2.016 . . . . 0.0 113.403 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -78.79 -12.02 60.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.206 1.402 . . . . 0.0 112.857 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . 0.259 95.1 m-85 . . . . . 0 C--N 1.345 0.38 0 C-N-CA 126.351 1.86 . . . . 0.0 112.221 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.2 mtp85 -70.7 -27.1 63.74 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.22 1.008 . . . . 0.0 112.063 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.7 173.32 5.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.09 2.156 . . . . 0.0 110.39 -169.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.0 t90 46.47 -125.15 1.43 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.313 1.845 . . . . 0.0 113.71 169.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -78.53 -15.61 58.39 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 125.456 1.503 . . . . 0.0 113.349 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 CA--C 1.538 0.488 0 C-N-CA 125.807 1.643 . . . . 0.0 112.176 -175.628 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.2 mtm-85 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.4 mtm-85 -73.67 -31.03 63.25 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.248 1.019 . . . . 0.0 112.277 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.09 172.03 10.45 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.575 1.95 . . . . 0.0 110.515 -169.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.7 t90 50.95 -137.77 1.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.936 1.694 . . . . 0.0 112.036 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -74.46 -17.84 60.72 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.893 1.277 . . . . 0.0 112.025 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 126.767 2.027 . . . . 0.0 112.106 -177.57 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 mtm180 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -79.97 -23.97 41.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.133 1.373 . . . . 0.0 112.097 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -168.98 177.44 4.93 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.116 2.166 . . . . 0.0 110.634 -171.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.6 t90 47.67 -132.76 1.32 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.618 1.967 . . . . 0.0 113.068 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -76.84 -14.16 59.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.257 1.423 . . . . 0.0 112.562 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 126.424 1.89 . . . . 0.0 113.096 -172.004 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.63 -32.79 68.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.157 1.383 . . . . 0.0 112.409 -172.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.4 -176.29 3.18 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.399 1.88 . . . . 0.0 111.016 -168.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.3 t90 50.48 -130.15 2.13 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.233 1.813 . . . . 0.0 111.846 169.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -79.66 -16.1 56.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.914 1.286 . . . . 0.0 112.758 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 126.763 2.025 . . . . 0.0 113.577 -169.777 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.5 mtp85 . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -81.42 -42.56 20.21 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.041 1.737 . . . . 0.0 110.828 -171.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.15 177.49 11.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.364 2.266 . . . . 0.0 110.895 -170.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.0 t90 50.12 -131.03 1.98 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.566 1.546 . . . . 0.0 112.12 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.11 -22.0 56.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.263 1.425 . . . . 0.0 112.21 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.528 0 C-N-CA 126.499 1.919 . . . . 0.0 113.082 -171.149 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -77.05 -27.71 54.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.47 1.108 . . . . 0.0 111.705 -173.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.78 -178.64 2.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.683 2.793 . . . . 0.0 109.983 -169.564 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.4 t90 46.44 -133.54 1.01 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.998 2.119 . . . . 0.0 113.553 169.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.7 -18.23 61.56 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.434 1.493 . . . . 0.0 112.455 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 125.896 1.678 . . . . 0.0 112.428 -169.585 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.75 -23.78 58.6 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.499 0.72 . . . . 0.0 112.712 -174.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -158.64 174.32 15.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.809 1.244 . . . . 0.0 110.773 -170.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.2 t90 45.69 -126.78 1.28 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.72 2.008 . . . . 0.0 113.32 169.708 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.5 mtt-85 -79.18 -16.53 56.46 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.92 1.688 . . . . 0.0 112.96 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.538 0.514 0 C-N-CA 126.187 1.795 . . . . 0.0 112.38 -172.496 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 mtp85 -84.91 -26.19 27.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.535 1.534 . . . . 0.0 111.63 -169.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -162.41 169.55 20.27 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 125.672 1.589 . . . . 0.0 110.399 -169.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 2.1 t90 47.25 -132.11 1.3 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.546 1.938 . . . . 0.0 111.562 -174.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -82.66 -14.78 54.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.063 1.345 . . . . 0.0 112.745 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 . . . . . 0 N--CA 1.449 -0.481 0 C-N-CA 126.57 1.948 . . . . 0.0 111.716 -179.41 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -63.43 -45.34 91.38 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.653 1.581 . . . . 0.0 111.859 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -163.29 -177.88 5.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 128.877 2.871 . . . . 0.0 110.526 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.1 t90 47.13 -130.11 1.48 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.618 1.967 . . . . 0.0 113.464 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -74.04 -17.86 60.92 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.499 1.52 . . . . 0.0 112.526 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.586 1.954 . . . . 0.0 112.415 -172.566 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 52.8 mtp85 -75.51 -24.86 56.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.522 1.129 . . . . 0.0 112.236 -172.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -172.27 178.95 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.605 2.762 . . . . 0.0 110.242 -169.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.6 t90 46.5 -132.33 1.14 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.741 2.016 . . . . 0.0 113.403 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -78.79 -12.02 60.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.206 1.402 . . . . 0.0 112.857 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . 0.259 95.1 m-85 . . . . . 0 C--N 1.345 0.38 0 C-N-CA 126.351 1.86 . . . . 0.0 112.221 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.2 mtp85 -70.7 -27.1 63.74 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.22 1.008 . . . . 0.0 112.063 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.7 173.32 5.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.09 2.156 . . . . 0.0 110.39 -169.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.0 t90 46.47 -125.15 1.43 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.313 1.845 . . . . 0.0 113.71 169.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -78.53 -15.61 58.39 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 125.456 1.503 . . . . 0.0 113.349 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 CA--C 1.538 0.488 0 C-N-CA 125.807 1.643 . . . . 0.0 112.176 -175.628 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.2 mtm-85 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.4 mtm-85 -73.67 -31.03 63.25 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.248 1.019 . . . . 0.0 112.277 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.09 172.03 10.45 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.575 1.95 . . . . 0.0 110.515 -169.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.7 t90 50.95 -137.77 1.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.936 1.694 . . . . 0.0 112.036 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -74.46 -17.84 60.72 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.893 1.277 . . . . 0.0 112.025 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 126.767 2.027 . . . . 0.0 112.106 -177.57 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 mtm180 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -79.97 -23.97 41.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.133 1.373 . . . . 0.0 112.097 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -168.98 177.44 4.93 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.116 2.166 . . . . 0.0 110.634 -171.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.6 t90 47.67 -132.76 1.32 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.618 1.967 . . . . 0.0 113.068 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -76.84 -14.16 59.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.257 1.423 . . . . 0.0 112.562 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 126.424 1.89 . . . . 0.0 113.096 -172.004 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.63 -32.79 68.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.157 1.383 . . . . 0.0 112.409 -172.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.4 -176.29 3.18 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.399 1.88 . . . . 0.0 111.016 -168.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.3 t90 50.48 -130.15 2.13 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.233 1.813 . . . . 0.0 111.846 169.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -79.66 -16.1 56.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.914 1.286 . . . . 0.0 112.758 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 126.763 2.025 . . . . 0.0 113.577 -169.777 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.5 mtp85 . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -81.42 -42.56 20.21 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.041 1.737 . . . . 0.0 110.828 -171.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.15 177.49 11.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.364 2.266 . . . . 0.0 110.895 -170.554 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.0 t90 50.12 -131.03 1.98 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.566 1.546 . . . . 0.0 112.12 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.11 -22.0 56.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.263 1.425 . . . . 0.0 112.21 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.528 0 C-N-CA 126.499 1.919 . . . . 0.0 113.082 -171.149 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -77.05 -27.71 54.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.47 1.108 . . . . 0.0 111.705 -173.602 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.78 -178.64 2.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.683 2.793 . . . . 0.0 109.983 -169.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.4 t90 46.44 -133.54 1.01 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.998 2.119 . . . . 0.0 113.553 169.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.7 -18.23 61.56 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.434 1.493 . . . . 0.0 112.455 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 125.896 1.678 . . . . 0.0 112.428 -169.585 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.75 -23.78 58.6 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.499 0.72 . . . . 0.0 112.712 -174.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -158.64 174.32 15.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.809 1.244 . . . . 0.0 110.773 -170.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.2 t90 45.69 -126.78 1.28 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.72 2.008 . . . . 0.0 113.32 169.708 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.5 mtt-85 -79.18 -16.53 56.46 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.92 1.688 . . . . 0.0 112.96 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.538 0.514 0 C-N-CA 126.187 1.795 . . . . 0.0 112.38 -172.496 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 mtp85 -84.91 -26.19 27.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.535 1.534 . . . . 0.0 111.63 -169.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -162.41 169.55 20.27 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 125.672 1.589 . . . . 0.0 110.399 -169.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 2.1 t90 47.25 -132.11 1.3 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.546 1.938 . . . . 0.0 111.562 -174.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -82.66 -14.78 54.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.063 1.345 . . . . 0.0 112.745 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 . . . . . 0 N--CA 1.449 -0.481 0 C-N-CA 126.57 1.948 . . . . 0.0 111.716 -179.41 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -63.43 -45.34 91.38 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.653 1.581 . . . . 0.0 111.859 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -163.29 -177.88 5.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 128.877 2.871 . . . . 0.0 110.526 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.1 t90 47.13 -130.11 1.48 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.618 1.967 . . . . 0.0 113.464 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -74.04 -17.86 60.92 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.499 1.52 . . . . 0.0 112.526 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.586 1.954 . . . . 0.0 112.415 -172.566 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 52.8 mtp85 -75.51 -24.86 56.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.522 1.129 . . . . 0.0 112.236 -172.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -172.27 178.95 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.605 2.762 . . . . 0.0 110.242 -169.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.6 t90 46.5 -132.33 1.14 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.741 2.016 . . . . 0.0 113.403 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -78.79 -12.02 60.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.206 1.402 . . . . 0.0 112.857 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . 0.259 95.1 m-85 . . . . . 0 C--N 1.345 0.38 0 C-N-CA 126.351 1.86 . . . . 0.0 112.221 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.2 mtp85 -70.7 -27.1 63.74 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.22 1.008 . . . . 0.0 112.063 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.7 173.32 5.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.09 2.156 . . . . 0.0 110.39 -169.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.0 t90 46.47 -125.15 1.43 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.313 1.845 . . . . 0.0 113.71 169.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -78.53 -15.61 58.39 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 125.456 1.503 . . . . 0.0 113.349 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 CA--C 1.538 0.488 0 C-N-CA 125.807 1.643 . . . . 0.0 112.176 -175.628 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.2 mtm-85 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.4 mtm-85 -73.67 -31.03 63.25 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.248 1.019 . . . . 0.0 112.277 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.09 172.03 10.45 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.575 1.95 . . . . 0.0 110.515 -169.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.7 t90 50.95 -137.77 1.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.936 1.694 . . . . 0.0 112.036 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -74.46 -17.84 60.72 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.893 1.277 . . . . 0.0 112.025 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 126.767 2.027 . . . . 0.0 112.106 -177.57 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 mtm180 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -79.97 -23.97 41.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.133 1.373 . . . . 0.0 112.097 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -168.98 177.44 4.93 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.116 2.166 . . . . 0.0 110.634 -171.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.6 t90 47.67 -132.76 1.32 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.618 1.967 . . . . 0.0 113.068 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -76.84 -14.16 59.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.257 1.423 . . . . 0.0 112.562 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 126.424 1.89 . . . . 0.0 113.096 -172.004 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.63 -32.79 68.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.157 1.383 . . . . 0.0 112.409 -172.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.4 -176.29 3.18 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.399 1.88 . . . . 0.0 111.016 -168.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.3 t90 50.48 -130.15 2.13 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.233 1.813 . . . . 0.0 111.846 169.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -79.66 -16.1 56.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.914 1.286 . . . . 0.0 112.758 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 126.763 2.025 . . . . 0.0 113.577 -169.777 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.5 mtp85 . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -81.42 -42.56 20.21 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.041 1.737 . . . . 0.0 110.828 -171.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.15 177.49 11.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.364 2.266 . . . . 0.0 110.895 -170.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.0 t90 50.12 -131.03 1.98 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.566 1.546 . . . . 0.0 112.12 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.11 -22.0 56.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.263 1.425 . . . . 0.0 112.21 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.528 0 C-N-CA 126.499 1.919 . . . . 0.0 113.082 -171.149 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -77.05 -27.71 54.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.47 1.108 . . . . 0.0 111.705 -173.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.78 -178.64 2.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.683 2.793 . . . . 0.0 109.983 -169.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.4 t90 46.44 -133.54 1.01 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.998 2.119 . . . . 0.0 113.553 169.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.7 -18.23 61.56 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.434 1.493 . . . . 0.0 112.455 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 125.896 1.678 . . . . 0.0 112.428 -169.585 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.75 -23.78 58.6 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.499 0.72 . . . . 0.0 112.712 -174.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -158.64 174.32 15.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.809 1.244 . . . . 0.0 110.773 -170.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.2 t90 45.69 -126.78 1.28 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.72 2.008 . . . . 0.0 113.32 169.708 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.5 mtt-85 -79.18 -16.53 56.46 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.92 1.688 . . . . 0.0 112.96 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.538 0.514 0 C-N-CA 126.187 1.795 . . . . 0.0 112.38 -172.496 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 mtp85 -84.91 -26.19 27.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.535 1.534 . . . . 0.0 111.63 -169.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -162.41 169.55 20.27 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 125.672 1.589 . . . . 0.0 110.399 -169.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 2.1 t90 47.25 -132.11 1.3 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.546 1.938 . . . . 0.0 111.562 -174.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -82.66 -14.78 54.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.063 1.345 . . . . 0.0 112.745 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 . . . . . 0 N--CA 1.449 -0.481 0 C-N-CA 126.57 1.948 . . . . 0.0 111.716 -179.41 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -63.43 -45.34 91.38 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.653 1.581 . . . . 0.0 111.859 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -163.29 -177.88 5.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 128.877 2.871 . . . . 0.0 110.526 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.1 t90 47.13 -130.11 1.48 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.618 1.967 . . . . 0.0 113.464 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -74.04 -17.86 60.92 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.499 1.52 . . . . 0.0 112.526 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.586 1.954 . . . . 0.0 112.415 -172.566 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 52.8 mtp85 -75.51 -24.86 56.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.522 1.129 . . . . 0.0 112.236 -172.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -172.27 178.95 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.605 2.762 . . . . 0.0 110.242 -169.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.6 t90 46.5 -132.33 1.14 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.741 2.016 . . . . 0.0 113.403 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -78.79 -12.02 60.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.206 1.402 . . . . 0.0 112.857 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . 0.259 95.1 m-85 . . . . . 0 C--N 1.345 0.38 0 C-N-CA 126.351 1.86 . . . . 0.0 112.221 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.2 mtp85 -70.7 -27.1 63.74 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.22 1.008 . . . . 0.0 112.063 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.7 173.32 5.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.09 2.156 . . . . 0.0 110.39 -169.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.0 t90 46.47 -125.15 1.43 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.313 1.845 . . . . 0.0 113.71 169.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -78.53 -15.61 58.39 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 125.456 1.503 . . . . 0.0 113.349 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 CA--C 1.538 0.488 0 C-N-CA 125.807 1.643 . . . . 0.0 112.176 -175.628 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.2 mtm-85 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.4 mtm-85 -73.67 -31.03 63.25 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.248 1.019 . . . . 0.0 112.277 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.09 172.03 10.45 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.575 1.95 . . . . 0.0 110.515 -169.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.7 t90 50.95 -137.77 1.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.936 1.694 . . . . 0.0 112.036 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -74.46 -17.84 60.72 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.893 1.277 . . . . 0.0 112.025 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 126.767 2.027 . . . . 0.0 112.106 -177.57 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 mtm180 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -79.97 -23.97 41.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.133 1.373 . . . . 0.0 112.097 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -168.98 177.44 4.93 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.116 2.166 . . . . 0.0 110.634 -171.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.6 t90 47.67 -132.76 1.32 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.618 1.967 . . . . 0.0 113.068 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -76.84 -14.16 59.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.257 1.423 . . . . 0.0 112.562 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 126.424 1.89 . . . . 0.0 113.096 -172.004 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.63 -32.79 68.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.157 1.383 . . . . 0.0 112.409 -172.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.4 -176.29 3.18 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.399 1.88 . . . . 0.0 111.016 -168.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.3 t90 50.48 -130.15 2.13 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.233 1.813 . . . . 0.0 111.846 169.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -79.66 -16.1 56.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.914 1.286 . . . . 0.0 112.758 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 126.763 2.025 . . . . 0.0 113.577 -169.777 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.5 mtp85 . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -81.42 -42.56 20.21 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.041 1.737 . . . . 0.0 110.828 -171.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.15 177.49 11.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.364 2.266 . . . . 0.0 110.895 -170.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.0 t90 50.12 -131.03 1.98 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.566 1.546 . . . . 0.0 112.12 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.11 -22.0 56.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.263 1.425 . . . . 0.0 112.21 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.528 0 C-N-CA 126.499 1.919 . . . . 0.0 113.082 -171.149 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -77.05 -27.71 54.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.47 1.108 . . . . 0.0 111.705 -173.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.78 -178.64 2.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.683 2.793 . . . . 0.0 109.983 -169.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.4 t90 46.44 -133.54 1.01 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.998 2.119 . . . . 0.0 113.553 169.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.7 -18.23 61.56 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.434 1.493 . . . . 0.0 112.455 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 125.896 1.678 . . . . 0.0 112.428 -169.585 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.75 -23.78 58.6 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.499 0.72 . . . . 0.0 112.712 -174.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -158.64 174.32 15.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.809 1.244 . . . . 0.0 110.773 -170.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.2 t90 45.69 -126.78 1.28 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.72 2.008 . . . . 0.0 113.32 169.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.5 mtt-85 -79.18 -16.53 56.46 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.92 1.688 . . . . 0.0 112.96 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.538 0.514 0 C-N-CA 126.187 1.795 . . . . 0.0 112.38 -172.496 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 mtp85 -84.91 -26.19 27.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.535 1.534 . . . . 0.0 111.63 -169.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -162.41 169.55 20.27 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 125.672 1.589 . . . . 0.0 110.399 -169.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 2.1 t90 47.25 -132.11 1.3 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.546 1.938 . . . . 0.0 111.562 -174.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -82.66 -14.78 54.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.063 1.345 . . . . 0.0 112.745 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 . . . . . 0 N--CA 1.449 -0.481 0 C-N-CA 126.57 1.948 . . . . 0.0 111.716 -179.41 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -63.43 -45.34 91.38 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.653 1.581 . . . . 0.0 111.859 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -163.29 -177.88 5.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 128.877 2.871 . . . . 0.0 110.526 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.1 t90 47.13 -130.11 1.48 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.618 1.967 . . . . 0.0 113.464 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -74.04 -17.86 60.92 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.499 1.52 . . . . 0.0 112.526 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.586 1.954 . . . . 0.0 112.415 -172.566 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 81.4 mtm-85 . . . . . 0 N--CA 1.453 -0.318 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 52.8 mtp85 -75.51 -24.86 56.87 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.522 1.129 . . . . 0.0 112.236 -172.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -172.27 178.95 2.7 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 128.605 2.762 . . . . 0.0 110.242 -169.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.6 t90 46.5 -132.33 1.14 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 126.741 2.016 . . . . 0.0 113.403 170.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -78.79 -12.02 60.01 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 125.206 1.402 . . . . 0.0 112.857 177.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . 0.259 95.1 m-85 . . . . . 0 C--N 1.345 0.38 0 C-N-CA 126.351 1.86 . . . . 0.0 112.221 -174.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 . . . . . 0 CA--C 1.53 0.197 0 N-CA-C 112.924 0.713 . . . . 0.0 112.924 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.2 mtp85 -70.7 -27.1 63.74 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.22 1.008 . . . . 0.0 112.063 -169.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.7 173.32 5.41 Favored 'General case' 0 N--CA 1.449 -0.512 0 C-N-CA 127.09 2.156 . . . . 0.0 110.39 -169.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.0 t90 46.47 -125.15 1.43 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 126.313 1.845 . . . . 0.0 113.71 169.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -78.53 -15.61 58.39 Favored 'General case' 0 C--N 1.347 0.47 0 C-N-CA 125.456 1.503 . . . . 0.0 113.349 -178.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 . . . . . 0 CA--C 1.538 0.488 0 C-N-CA 125.807 1.643 . . . . 0.0 112.176 -175.628 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 75.2 mtm-85 . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 111.842 0.312 . . . . 0.0 111.842 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 44.4 mtm-85 -73.67 -31.03 63.25 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 124.248 1.019 . . . . 0.0 112.277 -173.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.09 172.03 10.45 Favored 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 126.575 1.95 . . . . 0.0 110.515 -169.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 5.7 t90 50.95 -137.77 1.12 Allowed 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 125.936 1.694 . . . . 0.0 112.036 -177.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 98.0 mtt180 -74.46 -17.84 60.72 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.893 1.277 . . . . 0.0 112.025 176.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 126.767 2.027 . . . . 0.0 112.106 -177.57 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 39.8 mtm180 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.9 mtp85 -79.97 -23.97 41.26 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.133 1.373 . . . . 0.0 112.097 -169.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -168.98 177.44 4.93 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.116 2.166 . . . . 0.0 110.634 -171.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 4.6 t90 47.67 -132.76 1.32 Allowed 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 126.618 1.967 . . . . 0.0 113.068 174.438 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -76.84 -14.16 59.93 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.257 1.423 . . . . 0.0 112.562 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 . . . . . 0 CA--C 1.537 0.448 0 C-N-CA 126.424 1.89 . . . . 0.0 113.096 -172.004 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.25 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 72.9 mtp180 -71.63 -32.79 68.34 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.157 1.383 . . . . 0.0 112.409 -172.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -167.4 -176.29 3.18 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.399 1.88 . . . . 0.0 111.016 -168.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 8.3 t90 50.48 -130.15 2.13 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 126.233 1.813 . . . . 0.0 111.846 169.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -79.66 -16.1 56.38 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.914 1.286 . . . . 0.0 112.758 177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 . . . . . 0 CA--C 1.54 0.571 0 C-N-CA 126.763 2.025 . . . . 0.0 113.577 -169.777 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.5 mtp85 . . . . . 0 CA--C 1.533 0.3 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.1 mtp180 -81.42 -42.56 20.21 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 126.041 1.737 . . . . 0.0 110.828 -171.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -156.15 177.49 11.37 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.364 2.266 . . . . 0.0 110.895 -170.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 13.0 t90 50.12 -131.03 1.98 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.566 1.546 . . . . 0.0 112.12 175.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -76.11 -22.0 56.01 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.263 1.425 . . . . 0.0 112.21 175.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.448 -0.528 0 C-N-CA 126.499 1.919 . . . . 0.0 113.082 -171.149 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 . . . . . 0 N--CA 1.456 -0.133 0 N-CA-C 113.383 0.883 . . . . 0.0 113.383 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.4 mtp180 -77.05 -27.71 54.48 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.47 1.108 . . . . 0.0 111.705 -173.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -170.78 -178.64 2.62 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 128.683 2.793 . . . . 0.0 109.983 -169.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.4 t90 46.44 -133.54 1.01 Allowed 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 126.998 2.119 . . . . 0.0 113.553 169.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -72.7 -18.23 61.56 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 125.434 1.493 . . . . 0.0 112.455 175.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 . . . . . 0 N--CA 1.449 -0.501 0 C-N-CA 125.896 1.678 . . . . 0.0 112.428 -169.585 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 28.5 mmt180 . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.75 -23.78 58.6 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.499 0.72 . . . . 0.0 112.712 -174.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -158.64 174.32 15.24 Favored 'General case' 0 N--CA 1.447 -0.599 0 C-N-CA 124.809 1.244 . . . . 0.0 110.773 -170.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.2 t90 45.69 -126.78 1.28 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 126.72 2.008 . . . . 0.0 113.32 169.708 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 56.5 mtt-85 -79.18 -16.53 56.46 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.92 1.688 . . . . 0.0 112.96 177.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 . . . . . 0 CA--C 1.538 0.514 0 C-N-CA 126.187 1.795 . . . . 0.0 112.38 -172.496 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.7 mmt180 . . . . . 0 CA--C 1.531 0.215 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 33.9 mtp85 -84.91 -26.19 27.42 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.535 1.534 . . . . 0.0 111.63 -169.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -162.41 169.55 20.27 Favored 'General case' 0 N--CA 1.444 -0.775 0 C-N-CA 125.672 1.589 . . . . 0.0 110.399 -169.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 2.1 t90 47.25 -132.11 1.3 Allowed 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 126.546 1.938 . . . . 0.0 111.562 -174.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -82.66 -14.78 54.08 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 125.063 1.345 . . . . 0.0 112.745 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 . . . . . 0 N--CA 1.449 -0.481 0 C-N-CA 126.57 1.948 . . . . 0.0 111.716 -179.41 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.8 mmm180 . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 112.678 0.621 . . . . 0.0 112.678 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -63.43 -45.34 91.38 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.653 1.581 . . . . 0.0 111.859 -178.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -163.29 -177.88 5.61 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 128.877 2.871 . . . . 0.0 110.526 -169.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 9.1 t90 47.13 -130.11 1.48 Allowed 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 126.618 1.967 . . . . 0.0 113.464 169.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -74.04 -17.86 60.92 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 125.499 1.52 . . . . 0.0 112.526 177.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 84.4 m-85 . . . . . 0 N--CA 1.448 -0.542 0 C-N-CA 126.586 1.954 . . . . 0.0 112.415 -172.566 . . . . . . . . 0 0 . 1 stop_ save_