data_1dw5_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 1dw5 _Structure_validation_residue.Date_analyzed 2016-10-06 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' ' ' CYS . . . . . 0.548 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.343 0.592 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.541 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -96.52 162.81 13.31 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.22 -0.925 . . . . 0.0 110.032 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.498 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -107.12 161.66 13.69 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HE2' ' NH1' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -43.56 159.81 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.178 -1.189 . . . . 0.0 109.819 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.03 12.13 10.58 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' A' ' 2' ' ' LYS . . . -79.88 16.52 1.15 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.074 -1.251 . . . . 0.0 110.625 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER 56.33 154.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.207 -0.933 . . . . 0.0 110.479 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.3 p 178.38 -147.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.577 -0.702 . . . . 0.0 109.504 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.435 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.9 OUTLIER -137.28 -142.52 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.163 -0.961 . . . . 0.0 109.396 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 24.6 tpt180 -112.26 100.59 8.93 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.059 -1.026 . . . . 0.0 109.155 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 83.96 77.28 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.419 0.628 . . . . 0.0 109.842 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.484 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 10.3 mmt -125.11 -40.39 2.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.87 . . . . 0.0 108.815 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.482 ' OH ' HD21 ' A' ' 11' ' ' LEU . 16.2 m-85 70.69 52.51 0.31 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.496 -0.753 . . . . 0.0 110.942 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.484 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -116.76 -23.85 7.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 108.621 178.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 38.7 m -50.79 126.88 16.97 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.897 0.856 . . . . 0.0 109.605 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.548 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 4.1 t -58.22 -27.38 63.87 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.217 0.532 . . . . 0.0 109.638 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.1 t -154.34 75.55 1.0 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.214 -0.929 . . . . 0.0 109.698 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 149.5 -167.16 29.71 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.6 m -127.37 -164.55 1.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -1.163 . . . . 0.0 109.715 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.7 m -79.43 116.34 19.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -114.79 115.79 27.57 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.284 -0.885 . . . . 0.0 109.457 179.458 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 66.04 33.94 7.29 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.433 -0.792 . . . . 0.0 110.12 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -11.38 59.87 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 21' ' ' ARG . 12.1 mttt -115.43 -175.55 2.73 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.099 -1.236 . . . . 0.0 109.371 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.463 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.529 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.21 0.529 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.2 mptm? -83.52 157.67 22.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 109.96 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -90.46 157.95 26.06 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -49.46 157.88 0.47 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.123 -1.222 . . . . 0.0 110.234 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.56 7.48 15.27 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.26 24.75 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.021 -1.281 . . . . 0.0 110.833 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.41 156.17 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.063 -1.023 . . . . 0.0 110.598 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 22.1 p 177.47 -165.57 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.548 -0.72 . . . . 0.0 109.745 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -101.53 -145.14 0.35 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.395 -0.816 . . . . 0.0 109.295 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -95.0 -24.22 17.03 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.099 -1.001 . . . . 0.0 109.7 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.527 ' CD2' ' OH ' ' A' ' 13' ' ' TYR . 2.7 mp -133.08 -105.91 0.25 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.9 OUTLIER 67.41 -58.16 0.43 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.895 -1.128 . . . . 0.0 109.846 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.527 ' OH ' ' CD2' ' A' ' 11' ' ' LEU . 42.8 m-85 71.02 45.49 0.51 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.434 -0.791 . . . . 0.0 109.725 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 3.3 m-20 -104.23 -20.76 13.68 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.111 -0.993 . . . . 0.0 109.231 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.5 m -47.42 127.11 10.64 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.814 . . . . 0.0 109.532 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.529 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 5.0 t -66.18 -13.15 59.78 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.395 0.617 . . . . 0.0 109.522 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.11 117.64 4.62 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.405 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.33 -153.12 24.96 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 31.7 t -137.09 -158.96 0.91 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.195 -1.18 . . . . 0.0 109.56 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.0 114.71 21.45 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.244 -0.91 . . . . 0.0 109.647 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 23.4 mtp180 -104.57 117.46 34.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.1 -1.0 . . . . 0.0 109.488 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.434 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 3.1 m 59.84 13.49 3.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.506 -0.747 . . . . 0.0 109.837 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.447 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 111.83 -24.12 15.64 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.2 mtmt -96.03 169.36 10.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -1.162 . . . . 0.0 109.661 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.421 0 O-C-N 121.186 -0.946 . . . . 0.0 109.49 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.546 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.269 0.557 . . . . 0.0 109.584 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 17.0 mmtt -96.83 170.5 9.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.456 -0.777 . . . . 0.0 109.661 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 6' ' ' ALA . . . -103.09 151.97 18.01 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -51.85 155.22 1.81 Allowed 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.177 -1.19 . . . . 0.0 110.319 -179.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 67.13 0.25 9.41 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 27.25 0.33 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.82 -1.4 . . . . 0.0 110.993 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER 55.79 155.32 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.926 -1.109 . . . . 0.0 110.568 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.8 p 178.84 -175.17 0.2 Allowed 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.38 -0.825 . . . . 0.0 109.974 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 38.9 t -98.68 -142.01 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.364 -0.835 . . . . 0.0 109.233 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.465 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -92.34 -62.45 1.4 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.93 -1.106 . . . . 0.0 109.546 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mp -123.11 58.87 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.28 -0.887 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.0 mmm -81.93 -10.32 59.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.164 -0.96 . . . . 0.0 109.507 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 48.87 47.94 20.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 109.543 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 1.2 p30 -115.74 -19.55 10.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.1 m -62.38 124.8 21.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.224 -0.922 . . . . 0.0 109.933 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.546 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.73 -25.52 66.55 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.356 0.598 . . . . 0.0 109.707 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.14 112.33 4.34 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.162 -0.961 . . . . 0.0 109.558 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.42 -146.06 16.81 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.4 m -149.02 -169.11 3.29 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -1.119 . . . . 0.0 109.446 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.461 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.9 m -81.11 108.65 14.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.506 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 24' ' ' LYS . 18.2 ttt180 -104.57 121.81 44.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.244 -0.91 . . . . 0.0 109.677 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m 52.59 20.59 1.55 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.87 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.44 -21.35 39.49 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mttp -93.67 159.64 15.12 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.197 -1.178 . . . . 0.0 109.616 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.186 -0.946 . . . . 0.0 109.632 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.536 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.302 0.572 . . . . 0.0 109.552 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -84.36 158.96 20.97 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 109.54 -179.851 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.3 162.66 17.97 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 149.47 14.04 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.079 -1.248 . . . . 0.0 109.667 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.84 -23.37 29.14 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.541 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.3 74.78 3.86 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.737 -0.861 . . . . 0.0 108.966 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -22.51 145.09 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.854 0.835 . . . . 0.0 112.081 -179.247 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.4 p -147.75 -166.49 2.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 110.112 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.4 t -93.92 -122.87 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.347 -0.846 . . . . 0.0 109.27 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.75 -61.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.719 -1.238 . . . . 0.0 109.756 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.513 ' CD2' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -123.2 80.88 1.82 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.793 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.472 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.7 mmm -114.27 -25.33 8.5 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.187 -0.946 . . . . 0.0 109.156 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' CD2' ' A' ' 11' ' ' LEU . 29.1 m-85 70.29 38.13 1.48 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.357 -0.84 . . . . 0.0 109.656 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.33 -36.24 8.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.222 -0.924 . . . . 0.0 109.218 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.3 m -49.53 125.72 11.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.0 109.409 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.536 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -66.65 -15.06 63.21 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 121.312 0.577 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 18' ' ' GLY . 5.4 t -99.42 -144.57 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 0.0 109.125 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -50.42 -99.43 0.01 OUTLIER Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.413 ' O ' ' C ' ' A' ' 20' ' ' CYS . 21.3 p -151.54 176.07 11.69 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.078 -1.248 . . . . 0.0 109.432 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.4 m -44.28 129.1 6.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 109.303 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 1.2 ttt180 -131.47 140.93 49.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.033 -1.042 . . . . 0.0 109.491 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m 47.43 24.64 0.5 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.178 -0.951 . . . . 0.0 109.271 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.34 -23.68 17.5 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -105.57 165.61 11.03 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -1.172 . . . . 0.0 109.914 -179.774 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.148 -0.97 . . . . 0.0 109.467 -179.946 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.522 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 25.4 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.302 0.572 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmtm -113.21 -167.11 1.15 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.33 -0.857 . . . . 0.0 110.77 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.35 -178.01 15.19 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.93 151.23 15.09 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.084 -1.244 . . . . 0.0 109.59 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.93 -29.79 8.84 Favored Glycine 0 N--CA 1.485 1.959 0 N-CA-C 107.772 -2.131 . . . . 0.0 107.772 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.42 73.89 0.36 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.59 150.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.311 0.577 . . . . 0.0 110.371 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 23' ' ' GLY . 29.8 p -159.51 -163.57 1.2 Allowed 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.202 -0.936 . . . . 0.0 109.789 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.434 ' CB ' ' HG3' ' A' ' 12' ' ' MET . 7.7 t -94.99 -125.75 0.12 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.335 -0.853 . . . . 0.0 109.196 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -122.46 -31.38 3.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.748 -1.22 . . . . 0.0 109.748 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.37 19.72 3.99 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.434 ' HG3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -59.12 -25.42 63.82 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.959 -1.088 . . . . 0.0 108.853 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 53.28 80.57 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.87 . . . . 0.0 109.487 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' A' ' 15' ' ' CYS . 4.4 m-20 -136.35 -38.25 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.519 -0.738 . . . . 0.0 109.286 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 14' ' ' ASP . 7.6 m -43.55 124.74 3.67 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.085 0.945 . . . . 0.0 109.535 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.522 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -67.15 -24.15 65.87 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.416 0.627 . . . . 0.0 109.432 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 p -130.62 94.27 3.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.335 -0.853 . . . . 0.0 109.21 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.68 -163.69 15.43 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' CYS . 51.4 p -129.77 171.14 12.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.257 -1.143 . . . . 0.0 109.532 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.1 m -43.61 130.31 5.32 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.203 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -121.2 129.35 53.16 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.158 -0.964 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 43.7 m 48.19 22.62 0.44 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.36 -0.837 . . . . 0.0 109.586 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 102.33 -36.14 4.48 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.3 mttt -95.88 160.16 14.61 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.091 -1.241 . . . . 0.0 109.59 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.055 -1.028 . . . . 0.0 109.326 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.473 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.256 0.551 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.521 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -75.81 158.45 32.16 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.216 -0.927 . . . . 0.0 110.019 -179.724 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.32 158.42 19.95 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 3' ' ' GLY . 0.0 OUTLIER -45.3 156.53 0.11 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.059 -1.26 . . . . 0.0 110.136 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 55.62 11.0 3.57 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -80.92 22.49 0.61 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.808 -1.407 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 56.41 151.33 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.07 -1.019 . . . . 0.0 110.713 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.9 p 177.73 -151.06 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 109.881 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.439 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 68.2 m -115.27 -123.48 0.29 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.375 -0.828 . . . . 0.0 109.509 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 21.7 mmm180 -118.17 -41.24 2.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.777 -1.202 . . . . 0.0 109.798 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.58 70.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.194 -0.941 . . . . 0.0 109.623 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.2 mtm -102.56 -7.63 21.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 62.68 52.6 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.61 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -126.81 -9.07 6.09 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.0 109.811 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 83.4 m -72.23 119.65 16.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 4.2 t -68.82 -13.42 62.39 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.577 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 23.2 p -122.44 2.93 9.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.881 -1.137 . . . . 0.0 111.507 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 169.01 -124.0 1.13 Allowed Glycine 0 N--CA 1.494 2.52 0 C-N-CA 118.927 -1.606 . . . . 0.0 110.491 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -132.83 -161.82 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.434 -1.039 . . . . 0.0 109.714 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.1 m -86.07 128.39 34.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.413 -0.804 . . . . 0.0 110.262 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.0 141.75 50.71 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.326 -0.859 . . . . 0.0 108.819 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.0 t 47.72 23.55 0.44 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.307 -0.87 . . . . 0.0 109.496 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.52 -33.23 5.44 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.6 mttp -96.15 171.66 8.46 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.109 -1.23 . . . . 0.0 109.806 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 0.0 109.558 -179.991 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.53 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.326 0.584 . . . . 0.0 109.597 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -82.33 157.78 23.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 109.893 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.51 162.0 30.24 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.57 156.26 3.57 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.028 -1.278 . . . . 0.0 109.819 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 64.79 6.22 22.66 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.0 26.68 0.33 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.912 -1.346 . . . . 0.0 110.7 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.43 155.55 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.283 0 O-C-N 120.979 -1.076 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 16.5 p -179.2 -158.67 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.38 -0.825 . . . . 0.0 109.745 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.461 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 3.5 t -106.96 -102.37 0.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.648 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.461 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.0 ttt180 -140.23 -44.36 0.42 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.075 -1.016 . . . . 0.0 109.857 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.22 39.01 1.92 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.846 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.459 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 7.9 mmt -78.78 -22.48 46.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.074 -1.016 . . . . 0.0 109.156 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 12' ' ' MET . 38.9 m-85 60.85 73.14 0.49 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -0.871 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.94 9.58 3.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.322 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 18.5 m -86.13 125.41 33.47 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.178 -0.951 . . . . 0.0 109.794 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.53 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -66.7 -23.89 66.18 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.717 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -153.18 72.04 0.93 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.16 -0.963 . . . . 0.0 109.667 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 150.99 -167.96 30.63 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.3 t -138.55 161.32 37.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -1.117 . . . . 0.0 109.299 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.3 m -52.08 127.27 21.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.324 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.12 121.75 16.32 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.164 -0.96 . . . . 0.0 109.816 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.55 10.29 4.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 109.908 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.78 -2.44 33.97 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -121.99 174.48 6.88 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.045 -1.268 . . . . 0.0 109.64 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.62 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.515 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.6 mmtt -107.48 -166.75 1.18 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.247 -0.908 . . . . 0.0 109.946 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.46 160.54 25.15 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.452 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.4 pttp -53.55 152.0 5.37 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.959 -1.318 . . . . 0.0 109.451 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.03 -31.5 7.26 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 107.61 -2.196 . . . . 0.0 107.61 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.33 80.21 3.84 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.9 pttt -28.44 149.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.443 0.639 . . . . 0.0 110.739 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -150.98 -162.32 1.53 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.099 -1.001 . . . . 0.0 109.904 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.501 ' HB2' ' CG ' ' A' ' 12' ' ' MET . 73.2 m -94.07 -101.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.209 -0.932 . . . . 0.0 109.703 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -167.48 115.65 0.79 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.509 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 76.02 16.06 2.36 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.322 -0.861 . . . . 0.0 109.612 179.813 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.501 ' CG ' ' HB2' ' A' ' 9' ' ' SER . 36.4 mmt -74.17 -9.31 58.49 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.123 -0.986 . . . . 0.0 109.265 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 12' ' ' MET . 19.2 m-85 42.52 57.05 3.58 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -0.852 . . . . 0.0 109.549 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -116.55 -22.08 8.87 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.28 -0.887 . . . . 0.0 109.24 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.8 m -61.76 124.25 20.21 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.192 0.996 . . . . 0.0 109.837 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.515 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -66.9 -36.94 83.41 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.72 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 t -128.9 72.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.337 -0.852 . . . . 0.0 109.408 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.63 -158.3 26.54 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 p -148.63 168.16 23.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.101 . . . . 0.0 109.376 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 8.6 m -57.65 92.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.345 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 24' ' ' LYS . 8.8 ttm180 -103.7 135.23 45.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.325 -0.859 . . . . 0.0 109.403 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 t 58.6 22.13 9.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.247 -0.908 . . . . 0.0 109.379 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.13 -14.77 61.3 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 32.3 mttm -107.15 172.48 6.8 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.12 -1.223 . . . . 0.0 109.518 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.096 -1.003 . . . . 0.0 109.217 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.279 0.561 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HD2' ' HB2' ' A' ' 6' ' ' ALA . 15.4 mmtm -122.52 -167.65 1.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 109.838 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.431 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -143.72 161.88 27.74 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -41.1 148.52 0.11 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.365 -1.08 . . . . 0.0 110.107 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.97 -34.18 5.09 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 107.963 -2.055 . . . . 0.0 107.963 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.62 80.57 4.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.591 -0.946 . . . . 0.0 108.785 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -33.09 155.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.248 0.547 . . . . 0.0 110.39 -179.567 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -142.48 -145.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.032 -1.043 . . . . 0.0 109.904 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.541 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -111.95 7.16 19.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.816 -1.178 . . . . 0.0 110.351 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.541 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 82.95 -13.62 0.8 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.638 -0.664 . . . . 0.0 109.772 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.06 22.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.044 -1.035 . . . . 0.0 109.503 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.433 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.2 OUTLIER -83.25 -21.13 33.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.183 -0.948 . . . . 0.0 109.049 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.426 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.7 m-85 61.95 66.95 0.78 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.888 . . . . 0.0 109.837 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 15.9 p-10 -118.3 -20.25 8.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.189 -0.945 . . . . 0.0 109.257 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -60.68 127.38 31.39 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.919 0.866 . . . . 0.0 109.22 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -61.87 -41.1 97.45 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 17' ' ' THR . 1.3 t -131.6 120.75 23.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.409 -0.807 . . . . 0.0 108.977 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.18 -152.51 17.05 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.299 -1.52 . . . . 0.0 109.299 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 m -150.92 161.04 43.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.086 -1.244 . . . . 0.0 109.711 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.514 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -48.51 117.56 2.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 0.0 109.262 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.8 ttm180 -113.65 136.32 52.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.043 -1.036 . . . . 0.0 109.333 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 49.26 27.32 1.82 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 109.437 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.36 -22.22 21.06 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 7.1 mtmt -100.35 168.42 9.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.172 -1.193 . . . . 0.0 109.651 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 O-C-N 120.936 -1.102 . . . . 0.0 108.829 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.543 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.395 0.617 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.518 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -71.11 159.67 34.28 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.318 -0.864 . . . . 0.0 109.603 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.517 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -105.15 168.96 16.02 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -55.73 163.12 1.47 Allowed 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.086 -1.244 . . . . 0.0 109.655 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 43.84 25.1 0.56 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.517 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -79.59 21.86 0.49 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -1.126 . . . . 0.0 111.119 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.494 ' C ' ' O ' ' A' ' 6' ' ' ALA . 12.1 pttm 34.72 43.1 0.09 Allowed 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.992 0.901 . . . . 0.0 109.624 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.64 ' N ' ' O ' ' A' ' 23' ' ' GLY . 20.7 p -68.52 -148.95 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 CA-C-O 121.44 0.638 . . . . 0.0 109.923 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.44 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 0.6 OUTLIER -106.53 -140.45 0.37 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.575 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ttp180 -132.98 116.48 16.47 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.111 -0.993 . . . . 0.0 108.889 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER 63.42 45.57 4.78 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.723 -0.61 . . . . 0.0 109.854 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 1.4 mmm -100.06 -5.37 28.11 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.379 -0.826 . . . . 0.0 109.235 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 55.07 53.4 10.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.358 -0.839 . . . . 0.0 109.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.462 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 56.2 m-20 -124.12 -28.89 3.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.268 -0.895 . . . . 0.0 109.715 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 89.2 m -44.65 125.3 4.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 109.367 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.543 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -64.38 -28.69 69.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.41 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.455 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.3 p -153.66 31.8 0.46 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.024 -1.047 . . . . 0.0 109.73 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -154.9 -159.62 9.39 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' N ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -133.97 122.91 23.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -1.074 . . . . 0.0 109.219 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' SER . 1.6 m -43.01 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.53 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -113.32 137.82 50.94 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.182 -0.948 . . . . 0.0 109.268 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.47 24.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.042 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.64 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 87.0 -21.47 19.75 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 23.7 mttt -93.09 134.07 35.62 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.839 -1.389 . . . . 0.0 109.117 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.297 -1.71 0 O-C-N 121.568 -0.708 . . . . 0.0 109.526 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.537 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.318 0.58 . . . . 0.0 109.489 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -88.79 166.25 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.266 -0.896 . . . . 0.0 109.701 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -118.67 153.02 17.17 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -42.43 147.83 0.25 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -1.104 . . . . 0.0 110.02 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.97 -29.34 8.79 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.86 75.17 0.46 Allowed 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.541 -0.976 . . . . 0.0 108.529 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.574 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.26 149.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.614 0.721 . . . . 0.0 110.586 -179.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -152.11 -156.96 0.75 Allowed 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.213 -0.93 . . . . 0.0 109.799 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.452 ' HB3' ' HG2' ' A' ' 12' ' ' MET . 10.7 t -93.42 -110.86 0.11 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.289 -0.882 . . . . 0.0 109.52 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' OG ' ' A' ' 9' ' ' SER . 52.4 ttt180 -135.35 -45.7 0.69 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.775 -1.203 . . . . 0.0 110.024 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.16 45.57 2.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.006 -1.059 . . . . 0.0 109.951 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.452 ' HG2' ' HB3' ' A' ' 9' ' ' SER . 14.5 mmt -80.36 -36.98 33.3 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.069 -1.02 . . . . 0.0 109.058 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.42 ' HB2' ' O ' ' A' ' 12' ' ' MET . 5.0 m-30 60.16 35.24 21.13 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.43 -0.794 . . . . 0.0 109.989 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -94.96 -12.15 27.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.123 -0.985 . . . . 0.0 108.962 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.2 m -57.61 133.64 55.47 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.105 0.955 . . . . 0.0 109.607 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.537 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.0 t -66.05 -30.38 70.9 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.257 -179.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.452 ' O ' HG21 ' A' ' 17' ' ' THR . 1.7 t -142.32 81.0 1.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.952 -1.092 . . . . 0.0 109.952 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.48 -160.0 25.0 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.24 164.58 29.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.409 -1.054 . . . . 0.0 109.388 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 m -50.5 99.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -0.937 . . . . 0.0 109.521 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -112.98 145.93 39.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.139 -0.976 . . . . 0.0 109.746 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.7 t 55.31 26.33 8.49 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.443 -0.786 . . . . 0.0 109.519 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.67 -6.97 59.88 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -121.03 179.36 4.4 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.485 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.484 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.299 -1.593 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.954 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.54 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 4.1 p . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.291 0.567 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.6 mmtp -106.94 -176.77 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.21 -0.931 . . . . 0.0 110.107 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.54 163.91 12.66 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -50.25 156.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.948 -1.324 . . . . 0.0 109.19 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.66 -32.08 6.33 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -74.04 77.23 1.71 Allowed 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 178.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -30.71 150.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 121.338 0.589 . . . . 0.0 110.338 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -146.79 -166.09 2.41 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.986 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -94.31 -102.63 0.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.327 -0.858 . . . . 0.0 109.611 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.1 ttm180 -148.31 112.92 5.35 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.158 -0.964 . . . . 0.0 109.174 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.5 mt 64.01 28.25 14.34 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.445 -0.784 . . . . 0.0 109.453 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.407 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 2.5 mmt -58.74 -21.71 56.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.315 -0.866 . . . . 0.0 109.447 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 12' ' ' MET . 40.5 m-85 59.27 33.96 22.81 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.739 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -110.41 -30.48 7.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.253 -0.905 . . . . 0.0 109.241 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -54.37 124.43 15.95 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 122.214 1.007 . . . . 0.0 109.042 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.54 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.7 t -66.8 -25.09 66.29 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.759 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 18' ' ' GLY . 54.5 p -90.73 -128.84 0.09 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.237 -0.915 . . . . 0.0 109.089 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.9 -119.33 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.0 p -146.52 175.45 10.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.126 -1.22 . . . . 0.0 109.456 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.3 m -45.39 103.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.236 -0.915 . . . . 0.0 109.462 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.11 133.33 50.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 109.334 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.27 22.86 2.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.136 -0.978 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.43 -19.52 46.83 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.1 mtpt -101.22 159.46 15.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -1.162 . . . . 0.0 109.384 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.077 -1.014 . . . . 0.0 109.113 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.557 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.222 0.534 . . . . 0.0 109.759 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 27.0 mmtm -81.52 -171.73 3.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.301 -0.875 . . . . 0.0 109.618 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.491 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -122.79 161.92 16.81 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -58.75 162.67 3.83 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.295 -1.121 . . . . 0.0 109.777 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.499 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 47.79 24.14 2.8 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -78.62 21.87 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.321 -1.105 . . . . 0.0 111.479 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.515 ' C ' ' O ' ' A' ' 6' ' ' ALA . 19.9 ptmt 30.79 44.65 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 121.887 0.851 . . . . 0.0 110.11 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.61 ' N ' ' O ' ' A' ' 23' ' ' GLY . 29.7 p -70.63 -153.64 0.02 OUTLIER 'General case' 0 C--N 1.29 -2.012 0 O-C-N 121.815 -0.553 . . . . 0.0 109.869 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' HA2' ' A' ' 23' ' ' GLY . 1.4 t -103.26 -140.93 0.36 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 109.868 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.544 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.6 OUTLIER -128.43 108.43 10.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.067 -1.021 . . . . 0.0 109.148 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.544 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 80.2 53.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.555 -0.716 . . . . 0.0 109.52 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.8 mmm -103.27 -16.44 15.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.944 . . . . 0.0 109.289 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 57.09 50.7 11.51 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' C ' ' A' ' 15' ' ' CYS . 1.0 OUTLIER -124.13 -27.24 3.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.717 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.456 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 64.8 m -45.47 123.08 3.92 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 122.122 0.963 . . . . 0.0 109.763 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.557 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.7 t -67.28 -9.95 45.96 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.077 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.8 p -130.2 -5.13 4.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.716 -1.24 . . . . 0.0 111.006 -178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.456 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . -170.24 -127.84 0.97 Allowed Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.377 -1.392 . . . . 0.0 110.023 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.422 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 33.0 t -140.58 162.68 34.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.274 -1.133 . . . . 0.0 109.519 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.3 m -51.11 126.56 16.82 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.91 . . . . 0.0 109.636 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.13 123.35 40.11 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.165 -0.959 . . . . 0.0 109.061 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.75 27.45 4.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 108.765 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.61 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 91.06 -32.7 5.02 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 1.4 mttm -92.73 135.85 33.74 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.366 -1.079 . . . . 0.0 109.277 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.618 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.482 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.544 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.466 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 2.5 mptt -81.84 161.7 23.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.324 -0.86 . . . . 0.0 110.115 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -109.19 161.68 13.03 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 108.812 -1.715 . . . . 0.0 108.812 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -41.37 150.47 0.09 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.289 -1.124 . . . . 0.0 109.926 -179.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 96.22 -31.57 7.26 Favored Glycine 0 N--CA 1.487 2.069 0 N-CA-C 107.881 -2.087 . . . . 0.0 107.881 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.11 75.89 0.34 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -28.93 150.09 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.399 0.619 . . . . 0.0 110.475 -179.418 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.9 p -157.16 -161.67 1.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.136 -0.978 . . . . 0.0 109.735 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 86.9 p -98.84 -143.72 0.32 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.296 -0.877 . . . . 0.0 109.425 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -30.22 18.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.0 109.445 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mt -153.84 44.07 0.58 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.177 -0.952 . . . . 0.0 109.956 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -53.31 -23.68 9.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.065 -1.022 . . . . 0.0 109.162 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 12' ' ' MET . 10.7 m-85 63.67 36.1 11.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.622 179.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.03 -25.47 5.77 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.087 -1.008 . . . . 0.0 109.304 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.8 m -52.93 126.21 19.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.987 . . . . 0.0 109.157 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.544 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.87 -28.04 68.01 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.349 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.98 135.65 47.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.066 -1.021 . . . . 0.0 109.719 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.26 -176.29 3.89 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.26 -171.83 1.94 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.28 -1.129 . . . . 0.0 109.47 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 9' ' ' SER . 9.0 m -61.37 103.34 0.3 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.303 -0.873 . . . . 0.0 109.446 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . 28.6 tpt180 -97.81 135.72 39.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 t 51.5 32.52 8.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.278 -0.889 . . . . 0.0 109.718 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.27 -9.7 46.59 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -110.94 172.02 7.12 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.015 -1.286 . . . . 0.0 109.552 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m . . . . . 0 C--N 1.3 -1.562 0 C-N-CA 119.46 -0.896 . . . . 0.0 108.839 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.548 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 7.5 p . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 121.303 0.573 . . . . 0.0 109.535 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HD2' ' HB3' ' A' ' 6' ' ' ALA . 16.5 mmtt -99.04 168.96 9.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 109.91 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.45 169.43 20.47 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.02 156.97 13.68 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.177 -1.19 . . . . 0.0 110.102 -179.548 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.436 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 70.9 -0.87 26.94 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.06 22.03 0.54 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.971 -1.311 . . . . 0.0 110.963 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.88 154.17 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.941 -1.099 . . . . 0.0 110.46 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.485 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 30.9 p 175.14 173.95 0.23 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.482 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -93.33 -163.36 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.1 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.438 HH11 ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -60.61 -61.44 2.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.031 -1.043 . . . . 0.0 109.519 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' CZ ' ' A' ' 13' ' ' TYR . 2.6 mp -138.04 72.63 1.42 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.274 -0.891 . . . . 0.0 109.614 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.493 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -86.57 -14.9 41.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.105 -0.997 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.493 ' CD2' ' O ' ' A' ' 12' ' ' MET . 3.9 m-85 69.29 54.73 0.41 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -130.23 -11.19 4.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.136 -0.977 . . . . 0.0 110.134 -179.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.1 m -73.15 124.62 25.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.118 -0.989 . . . . 0.0 109.882 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.548 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -67.09 -27.4 67.32 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 121.369 0.604 . . . . 0.0 109.42 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -150.91 126.85 10.39 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.261 -0.899 . . . . 0.0 109.281 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.26 -166.93 28.61 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.07 -167.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -1.147 . . . . 0.0 109.673 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.482 ' SG ' ' O ' ' A' ' 9' ' ' SER . 6.9 m -85.43 117.38 24.31 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.361 -0.837 . . . . 0.0 109.728 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -122.67 131.01 53.61 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.167 -0.958 . . . . 0.0 109.268 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 57.41 28.18 15.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.294 -0.879 . . . . 0.0 109.208 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.93 7.63 88.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 10.5 mtpt -120.26 162.34 19.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.191 -1.182 . . . . 0.0 110.0 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.401 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.462 -0.774 . . . . 0.0 109.301 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.533 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -111.15 168.62 9.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.86 . . . . 0.0 109.976 -179.629 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.2 165.17 25.06 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 153.55 24.17 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.094 -1.239 . . . . 0.0 110.109 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.71 2.73 12.47 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.12 28.64 0.29 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.825 -1.397 . . . . 0.0 110.902 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.56 157.04 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.893 -1.13 . . . . 0.0 110.358 -179.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.523 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.2 p 179.23 -174.06 0.2 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.432 -0.793 . . . . 0.0 109.961 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.2 t -94.48 -118.52 0.1 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.248 -0.907 . . . . 0.0 109.404 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.511 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -119.86 -76.65 0.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.915 -1.116 . . . . 0.0 109.679 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.76 28.51 8.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.054 -1.029 . . . . 0.0 109.756 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mmt -59.09 -22.65 61.15 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.295 -0.878 . . . . 0.0 109.204 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 4.0 m-85 62.76 56.61 1.9 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.405 -0.81 . . . . 0.0 109.845 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.425 ' O ' ' C ' ' A' ' 15' ' ' CYS . 75.2 m-20 -114.38 -37.94 4.21 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 28.4 m -44.1 125.03 4.2 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 109.544 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.533 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.2 t -66.81 -10.09 44.1 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.936 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 18' ' ' GLY . 17.6 p -146.21 -106.65 0.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.891 . . . . 0.0 109.556 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -43.82 167.16 0.02 OUTLIER Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 p -94.94 -168.85 1.88 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.204 -1.174 . . . . 0.0 109.614 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.0 m -81.92 117.52 22.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.315 -0.865 . . . . 0.0 109.792 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.27 113.44 26.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.129 -0.982 . . . . 0.0 109.324 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 16.35 2.01 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.686 -0.634 . . . . 0.0 109.804 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 112.18 -19.11 22.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.1 mtpp -93.48 151.92 19.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.099 -1.236 . . . . 0.0 109.637 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 109.55 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.546 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.5 p . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.354 0.597 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HA ' ' CE ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -90.48 -169.4 2.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.534 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -121.18 153.2 16.67 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 6' ' ' ALA . 1.2 ttmt -48.84 152.77 0.95 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.935 -1.332 . . . . 0.0 109.958 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 45.95 18.03 0.23 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -81.36 26.17 0.47 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.318 . . . . 0.0 110.715 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.77 157.9 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.042 -1.036 . . . . 0.0 110.284 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 15.5 p -179.48 -157.64 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.352 -0.842 . . . . 0.0 110.115 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.85 -89.27 0.58 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.402 -0.811 . . . . 0.0 109.739 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.52 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -141.41 -118.72 0.11 Allowed 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.421 -0.799 . . . . 0.0 109.861 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.561 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 3.8 mm? -79.01 52.9 1.33 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.737 -1.227 . . . . 0.0 110.02 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.7 mmm -75.78 -13.14 60.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.134 -0.979 . . . . 0.0 109.003 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.43 ' CE1' HD13 ' A' ' 11' ' ' LEU . 23.8 m-85 53.32 47.02 25.17 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.393 -0.817 . . . . 0.0 109.968 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' CYS . 12.7 t0 -110.87 -30.04 7.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 109.235 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 19' ' ' SER . 74.4 m -43.58 124.19 3.44 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.093 0.949 . . . . 0.0 109.404 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.546 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.77 -22.99 66.02 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.522 ' O ' ' CG2' ' A' ' 17' ' ' THR . 10.4 t -153.96 54.5 0.71 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.967 . . . . 0.0 109.746 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.39 -147.51 11.86 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 28.3 t -146.26 -162.8 1.6 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.337 -1.096 . . . . 0.0 109.526 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.0 m -94.43 105.3 17.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.744 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.7 OUTLIER -119.38 131.89 55.75 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.203 -0.935 . . . . 0.0 109.061 179.665 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' SER . . . . . 0.408 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 22.7 t 62.5 14.82 7.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.323 -0.861 . . . . 0.0 109.322 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.441 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.16 -23.87 34.29 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.2 mtmm -100.55 170.16 8.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.21 -1.171 . . . . 0.0 109.934 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.549 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.546 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.388 0.613 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 2.7 mptp? -84.84 -174.97 5.56 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.0 109.843 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.21 169.56 14.91 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.464 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.7 mtpt -57.21 150.75 17.03 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.103 -1.233 . . . . 0.0 109.959 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.36 -4.87 38.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.507 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.9 25.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.245 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.62 157.59 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 O-C-N 120.941 -1.099 . . . . 0.0 110.884 179.835 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.0 p -179.9 -157.47 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.438 -0.789 . . . . 0.0 109.789 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.464 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 0.3 OUTLIER -116.78 -82.79 0.63 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.924 . . . . 0.0 109.548 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.523 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -156.96 -66.65 0.1 Allowed 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.428 -0.795 . . . . 0.0 109.902 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.443 HD12 ' HB3' ' A' ' 10' ' ' ARG . 2.3 mp -107.51 24.58 12.67 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.094 -1.004 . . . . 0.0 109.955 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.464 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 0.0 OUTLIER -57.25 -26.64 61.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.171 -0.956 . . . . 0.0 108.9 179.536 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 49.32 33.44 5.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.495 -0.753 . . . . 0.0 110.073 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.52 -24.56 16.01 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.122 -0.986 . . . . 0.0 108.924 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 m -51.84 125.07 14.1 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 122.19 0.995 . . . . 0.0 109.568 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.546 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.4 t -67.0 -12.56 60.21 Favored 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.6 p -106.07 -122.23 0.23 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.219 -0.926 . . . . 0.0 109.745 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.21 -129.58 0.08 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -120.85 -171.68 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.276 -1.132 . . . . 0.0 109.7 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.8 m -63.22 155.24 28.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.684 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -146.08 124.46 12.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.333 -0.855 . . . . 0.0 109.334 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.1 m 52.1 24.61 2.79 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.846 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.452 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.13 -24.24 32.69 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.3 mttt -93.95 177.39 6.0 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.048 -1.266 . . . . 0.0 109.544 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.464 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.579 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.544 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.294 0.568 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -113.68 168.53 9.69 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.274 -0.891 . . . . 0.0 109.552 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.41 154.35 17.14 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -55.33 155.42 5.13 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.967 -1.313 . . . . 0.0 109.748 -179.765 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.5 -13.32 11.86 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.524 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.16 37.74 0.33 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.82 -1.4 . . . . 0.0 111.097 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 mttp 50.57 167.94 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.5 p 179.17 -175.54 0.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.076 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.466 ' O ' ' HD3' ' A' ' 10' ' ' ARG . 2.9 m -105.26 -103.74 0.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.355 -0.84 . . . . 0.0 109.514 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.466 ' HD3' ' O ' ' A' ' 9' ' ' SER . 3.2 mmt180 -128.26 -106.99 0.3 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.038 -1.039 . . . . 0.0 109.592 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.55 70.01 3.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.736 -1.228 . . . . 0.0 109.606 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 19.2 mmt -97.66 -31.71 12.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -0.906 . . . . 0.0 109.547 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.513 ' CB ' ' O ' ' A' ' 12' ' ' MET . 3.1 m-85 77.56 40.91 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.5 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.445 ' OD2' ' HB2' ' A' ' 12' ' ' MET . 2.9 m-20 -96.48 -25.47 15.65 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.133 -0.979 . . . . 0.0 109.236 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 33.2 m -55.54 127.03 27.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.218 -0.926 . . . . 0.0 109.776 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.544 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -65.76 -30.58 71.26 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.542 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.463 HG21 ' O ' ' A' ' 16' ' ' CYS . 1.2 p -150.55 37.49 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.003 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -164.94 -155.52 8.52 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 p -147.93 167.91 23.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.35 -1.088 . . . . 0.0 109.047 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 1.6 m -56.03 125.06 19.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.105 -0.997 . . . . 0.0 109.215 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -121.2 100.22 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.173 -0.954 . . . . 0.0 109.689 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.98 2.21 3.48 Favored 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.84 -0.538 . . . . 0.0 110.316 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.458 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 137.74 -30.24 2.59 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 119.587 -1.292 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -102.73 177.31 4.89 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.995 -1.297 . . . . 0.0 109.998 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.473 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.421 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.544 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.396 0.617 . . . . 0.0 109.609 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -104.61 165.09 11.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.901 . . . . 0.0 109.759 -179.775 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.43 165.0 16.66 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.96 150.08 30.01 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.123 -1.222 . . . . 0.0 110.389 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 57.14 9.05 3.76 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.77 27.68 0.37 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.727 -1.454 . . . . 0.0 110.647 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.72 154.46 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 O-C-N 121.039 -1.038 . . . . 0.0 110.894 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 14.9 p -178.71 -158.19 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.8 p -98.0 -131.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.366 -0.834 . . . . 0.0 109.496 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.447 ' O ' ' CG ' ' A' ' 11' ' ' LEU . 65.9 mtm180 -134.63 -0.5 2.88 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.786 -1.196 . . . . 0.0 110.382 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.447 ' CG ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -174.44 35.12 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.785 -1.197 . . . . 0.0 110.566 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.422 ' CB ' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -91.22 -19.57 22.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.17 -0.956 . . . . 0.0 108.793 179.25 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.1 m-85 61.61 57.92 2.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.468 -0.77 . . . . 0.0 110.253 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.422 ' OD1' ' CB ' ' A' ' 12' ' ' MET . 0.8 OUTLIER -106.82 -11.05 15.86 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.224 -0.922 . . . . 0.0 109.014 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 72.8 m -57.82 125.76 24.45 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 122.05 0.929 . . . . 0.0 110.026 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.544 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.9 t -57.96 -33.01 68.39 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.967 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -143.27 -22.03 0.62 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.06 -1.025 . . . . 0.0 111.276 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.488 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -101.69 -148.33 21.2 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.432 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 66.1 p -140.25 -174.17 3.87 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.426 -1.044 . . . . 0.0 108.994 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 m -91.78 96.18 10.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.02 -1.05 . . . . 0.0 109.395 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 143.78 50.67 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 65.2 28.61 12.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.284 -0.885 . . . . 0.0 109.578 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.99 11.65 67.04 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.2 mtmm -140.83 173.3 11.62 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.295 -1.769 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.101 179.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.522 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.269 0.556 . . . . 0.0 109.515 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 11.7 mmtt -95.11 -172.4 2.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.387 -0.821 . . . . 0.0 109.962 -179.51 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.439 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -139.73 157.54 25.28 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -43.65 152.05 0.17 Allowed 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.294 -1.121 . . . . 0.0 109.699 -179.856 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.18 -30.27 6.45 Favored Glycine 0 N--CA 1.485 1.955 0 N-CA-C 108.245 -1.942 . . . . 0.0 108.245 -179.055 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.07 76.19 3.63 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.459 -1.024 . . . . 0.0 108.533 179.248 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.47 153.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.177 0.513 . . . . 0.0 110.222 -179.652 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 24.6 p -144.28 -160.48 1.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.071 -1.018 . . . . 0.0 109.518 -179.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.02 -83.7 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.127 -0.983 . . . . 0.0 109.459 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -175.18 105.82 0.09 Allowed 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.469 -0.77 . . . . 0.0 109.64 -179.975 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 70.06 44.33 0.8 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.328 -0.858 . . . . 0.0 109.899 179.807 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.443 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 13.5 mmm -90.52 -15.61 30.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 109.0 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 55.62 59.29 3.94 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.726 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 5.1 m-20 -124.21 -30.18 3.48 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.194 -0.941 . . . . 0.0 109.523 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 12.2 m -49.56 125.0 10.46 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 122.066 0.936 . . . . 0.0 109.348 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.522 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.5 t -66.77 -14.65 62.85 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.125 -179.558 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 t -119.71 31.73 6.41 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.085 -1.009 . . . . 0.0 109.862 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 141.98 -150.89 22.42 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 179.771 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 20' ' ' CYS . 7.5 p -124.16 175.88 6.74 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.364 -1.08 . . . . 0.0 109.288 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 19' ' ' SER . 16.8 m -44.58 147.11 0.63 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.205 -0.934 . . . . 0.0 109.62 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.1 ttt180 -123.6 100.8 6.98 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -0.822 . . . . 0.0 108.841 179.377 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 p 59.89 12.89 3.29 Favored 'General case' 0 C--N 1.292 -1.903 0 O-C-N 121.801 -0.562 . . . . 0.0 110.045 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.46 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 127.92 -37.71 2.25 Favored Glycine 0 N--CA 1.493 2.457 0 C-N-CA 119.803 -1.189 . . . . 0.0 110.241 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -103.07 162.59 12.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.1 -1.235 . . . . 0.0 109.86 -179.509 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 O-C-N 120.823 -1.173 . . . . 0.0 109.012 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.533 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -116.36 -167.49 1.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.195 -0.94 . . . . 0.0 110.332 -179.015 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.02 161.46 25.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -59.53 152.78 21.12 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.421 . . . . 0.0 109.37 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.58 -34.73 4.68 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 107.311 -2.316 . . . . 0.0 107.311 -178.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.39 83.33 3.83 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.67 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.57 152.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.361 0.6 . . . . 0.0 110.527 -179.549 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -156.95 -156.18 0.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.02 -1.05 . . . . 0.0 109.848 -179.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -93.73 -137.29 0.2 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 -179.754 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.483 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 2.6 mtp180 -134.77 112.79 11.02 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 120.923 -1.11 . . . . 0.0 109.191 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.6 mp 63.64 65.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.618 -0.676 . . . . 0.0 109.564 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -116.68 -16.62 10.68 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.417 -0.802 . . . . 0.0 109.23 179.828 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB2' ' O ' ' A' ' 12' ' ' MET . 18.0 m-85 66.26 43.84 2.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -0.856 . . . . 0.0 109.889 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.461 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 11.8 m-20 -110.83 -34.04 6.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.179 -0.951 . . . . 0.0 109.465 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 27.2 m -52.45 124.22 12.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.142 -0.974 . . . . 0.0 109.207 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.533 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.34 -24.28 66.5 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.656 -179.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.99 83.75 2.0 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.305 -0.872 . . . . 0.0 109.491 179.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.88 -154.76 16.71 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 t -147.44 158.0 43.8 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.245 -1.15 . . . . 0.0 109.488 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.7 m -45.75 103.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.837 . . . . 0.0 109.382 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . 38.9 ttp180 -111.9 136.04 51.72 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.093 -1.004 . . . . 0.0 109.453 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.21 14.3 4.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.368 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.31 -23.49 35.1 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -104.65 176.38 5.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.172 -1.193 . . . . 0.0 109.798 -179.914 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.53 0 C-N-CA 119.326 -0.95 . . . . 0.0 109.004 179.792 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.542 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -106.07 173.85 6.14 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.218 -0.926 . . . . 0.0 109.655 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -122.81 155.95 17.21 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 2.0 ttmt -41.88 150.82 0.11 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 121.283 -1.128 . . . . 0.0 109.815 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.77 -31.47 6.17 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 108.064 -2.015 . . . . 0.0 108.064 -179.105 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -71.98 75.83 0.92 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.554 -0.968 . . . . 0.0 108.563 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.38 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.223 0.535 . . . . 0.0 110.346 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -148.63 -168.27 3.05 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.017 -1.052 . . . . 0.0 110.09 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.62 -88.97 0.22 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.773 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HB3' HD23 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -148.52 -74.74 0.18 Allowed 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.505 -0.747 . . . . 0.0 109.528 -179.585 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.551 ' N ' ' CD2' ' A' ' 11' ' ' LEU . 3.6 mm? -108.87 33.74 4.07 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.718 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -20.6 66.17 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.148 -0.97 . . . . 0.0 109.336 179.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 57.2 65.92 1.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.854 . . . . 0.0 109.703 179.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.77 -32.35 2.36 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.213 -0.929 . . . . 0.0 109.612 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -56.67 126.9 28.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.931 . . . . 0.0 109.259 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.542 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.0 t -66.37 -33.92 76.8 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.235 0.54 . . . . 0.0 109.583 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.67 130.82 56.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 109.354 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 58.72 -166.41 7.44 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.431 -1.467 . . . . 0.0 109.431 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' C ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.41 179.65 4.24 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.226 -1.161 . . . . 0.0 109.482 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.408 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.3 m -43.76 130.2 5.55 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.352 -0.843 . . . . 0.0 109.258 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -127.91 123.09 34.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.29 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.71 24.4 14.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.242 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.65 -19.65 39.62 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.1 mttm -109.26 171.9 7.16 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.108 -1.231 . . . . 0.0 109.346 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.484 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m . . . . . 0 C--N 1.299 -1.593 0 C-N-CA 119.309 -0.957 . . . . 0.0 109.031 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.502 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.387 0.613 . . . . 0.0 109.544 . . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.8 mmtt -88.74 -178.8 5.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 109.877 -179.523 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -135.3 169.43 23.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp -47.3 148.92 1.14 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 120.924 -1.339 . . . . 0.0 109.615 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.21 -33.18 5.23 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 107.831 -2.107 . . . . 0.0 107.831 -178.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -70.38 75.25 0.54 Allowed 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 4.0 ptmt -31.76 151.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.451 0.643 . . . . 0.0 110.249 -179.079 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.06 -164.24 1.65 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.17 -0.956 . . . . 0.0 109.542 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -94.06 -164.76 1.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 109.233 179.99 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -75.72 -25.5 56.67 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.085 -1.01 . . . . 0.0 109.177 179.727 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.574 HD22 ' CZ ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -156.63 91.05 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 0.0 109.393 179.75 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.534 ' C ' ' CD2' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -114.98 -15.02 11.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.245 -0.909 . . . . 0.0 109.295 -179.866 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.574 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 1.5 m-85 55.79 30.66 16.14 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.875 . . . . 0.0 109.591 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . 0.428 ' CG ' ' HB3' ' A' ' 12' ' ' MET . 3.3 p30 -101.86 -31.15 10.86 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.166 -0.959 . . . . 0.0 109.345 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -54.67 124.5 16.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.108 -0.995 . . . . 0.0 108.918 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.502 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -66.29 -30.87 71.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 121.354 0.597 . . . . 0.0 109.484 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -130.96 128.06 39.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.306 -0.872 . . . . 0.0 109.393 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.45 -151.75 34.91 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.38 -157.67 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -1.155 . . . . 0.0 109.621 -179.963 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 9' ' ' SER . 21.8 m -86.09 96.7 9.96 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 109.529 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 24.8 ttp180 -95.04 139.35 31.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.046 -1.034 . . . . 0.0 109.786 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.9 m 53.63 20.63 2.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -0.01 81.92 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.9 mtmm -118.52 164.91 14.59 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.139 -1.212 . . . . 0.0 109.882 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 119.299 -0.96 . . . . 0.0 108.782 179.597 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' CYS . . . . . 0.572 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.42 0.629 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.541 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -82.52 162.68 21.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.334 -0.854 . . . . 0.0 109.668 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.66 160.08 18.19 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.964 -1.655 . . . . 0.0 108.964 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -50.98 146.78 5.71 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.161 -1.199 . . . . 0.0 110.715 -179.401 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.463 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 71.51 -10.92 3.43 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 179.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.67 36.69 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.576 -1.543 . . . . 0.0 111.392 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 51.67 161.19 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.122 -0.987 . . . . 0.0 110.988 179.731 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' GLY . 24.4 p 179.05 -167.0 0.07 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.237 -0.914 . . . . 0.0 109.665 179.926 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.525 ' CB ' ' HB2' ' A' ' 12' ' ' MET . 0.3 OUTLIER -93.73 -161.8 0.88 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.426 -0.797 . . . . 0.0 109.234 -179.95 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.74 -32.58 15.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.031 -1.043 . . . . 0.0 108.9 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 mp -153.18 22.37 0.56 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' MET . . . . . 0.525 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 57.2 tpp -62.56 -17.74 60.61 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.3 m-85 63.27 49.03 3.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.471 -0.768 . . . . 0.0 110.344 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.75 -21.31 15.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 0.0 108.548 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.2 m -56.23 125.59 22.45 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 122.038 0.923 . . . . 0.0 109.264 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.572 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.1 -34.89 79.1 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.595 -179.759 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.485 ' CG2' ' O ' ' A' ' 17' ' ' THR . 9.7 t -154.56 89.89 1.29 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.35 -0.844 . . . . 0.0 109.346 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 151.85 -149.77 21.54 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 m -139.31 178.33 7.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.165 -1.197 . . . . 0.0 109.458 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.8 m -95.68 106.92 19.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.885 . . . . 0.0 109.729 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -118.06 135.84 53.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.484 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.26 28.81 4.45 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.323 -0.86 . . . . 0.0 109.681 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 80.02 -5.98 60.84 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 17.7 mttm -100.55 146.15 27.46 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.329 -1.1 . . . . 0.0 109.156 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.443 0 O-C-N 121.163 -0.961 . . . . 0.0 109.146 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.548 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.343 0.592 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.541 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -96.52 162.81 13.31 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.22 -0.925 . . . . 0.0 110.032 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.498 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -107.12 161.66 13.69 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HE2' ' NH1' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -43.56 159.81 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.178 -1.189 . . . . 0.0 109.819 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.03 12.13 10.58 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.52 ' CB ' ' HB3' ' A' ' 2' ' ' LYS . . . -79.88 16.52 1.15 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.074 -1.251 . . . . 0.0 110.625 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER 56.33 154.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.207 -0.933 . . . . 0.0 110.479 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.462 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.3 p 178.38 -147.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.577 -0.702 . . . . 0.0 109.504 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.435 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.9 OUTLIER -137.28 -142.52 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.163 -0.961 . . . . 0.0 109.396 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 24.6 tpt180 -112.26 100.59 8.93 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.059 -1.026 . . . . 0.0 109.155 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 83.96 77.28 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.419 0.628 . . . . 0.0 109.842 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.484 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 10.3 mmt -125.11 -40.39 2.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.87 . . . . 0.0 108.815 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.482 ' OH ' HD21 ' A' ' 11' ' ' LEU . 16.2 m-85 70.69 52.51 0.31 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.496 -0.753 . . . . 0.0 110.942 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.484 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -116.76 -23.85 7.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 108.621 178.685 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 38.7 m -50.79 126.88 16.97 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.897 0.856 . . . . 0.0 109.605 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.548 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 4.1 t -58.22 -27.38 63.87 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.217 0.532 . . . . 0.0 109.638 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 5.1 t -154.34 75.55 1.0 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.214 -0.929 . . . . 0.0 109.698 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 149.5 -167.16 29.71 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.6 m -127.37 -164.55 1.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -1.163 . . . . 0.0 109.715 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.7 m -79.43 116.34 19.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -114.79 115.79 27.57 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.284 -0.885 . . . . 0.0 109.457 179.458 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 66.04 33.94 7.29 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.433 -0.792 . . . . 0.0 110.12 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -11.38 59.87 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 21' ' ' ARG . 12.1 mttt -115.43 -175.55 2.73 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.099 -1.236 . . . . 0.0 109.371 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.79 172.24 11.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.463 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 119.904 -1.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.529 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.21 0.529 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.506 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.2 mptm? -83.52 157.67 22.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 109.96 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.421 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -90.46 157.95 26.06 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -49.46 157.88 0.47 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.123 -1.222 . . . . 0.0 110.234 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.56 7.48 15.27 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.26 24.75 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.021 -1.281 . . . . 0.0 110.833 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.41 156.17 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.063 -1.023 . . . . 0.0 110.598 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 22.1 p 177.47 -165.57 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.548 -0.72 . . . . 0.0 109.745 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.4 t -101.53 -145.14 0.35 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.395 -0.816 . . . . 0.0 109.295 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -95.0 -24.22 17.03 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.099 -1.001 . . . . 0.0 109.7 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.527 ' CD2' ' OH ' ' A' ' 13' ' ' TYR . 2.7 mp -133.08 -105.91 0.25 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.502 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.9 OUTLIER 67.41 -58.16 0.43 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.895 -1.128 . . . . 0.0 109.846 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.527 ' OH ' ' CD2' ' A' ' 11' ' ' LEU . 42.8 m-85 71.02 45.49 0.51 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.434 -0.791 . . . . 0.0 109.725 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 3.3 m-20 -104.23 -20.76 13.68 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.111 -0.993 . . . . 0.0 109.231 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.5 m -47.42 127.11 10.64 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.814 . . . . 0.0 109.532 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.529 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 5.0 t -66.18 -13.15 59.78 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.395 0.617 . . . . 0.0 109.522 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.11 117.64 4.62 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.405 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.33 -153.12 24.96 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 31.7 t -137.09 -158.96 0.91 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.195 -1.18 . . . . 0.0 109.56 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.3 m -83.0 114.71 21.45 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.244 -0.91 . . . . 0.0 109.647 -179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 23.4 mtp180 -104.57 117.46 34.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.1 -1.0 . . . . 0.0 109.488 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.434 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 3.1 m 59.84 13.49 3.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.506 -0.747 . . . . 0.0 109.837 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.447 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 111.83 -24.12 15.64 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.538 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.2 mtmt -96.03 169.36 10.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -1.162 . . . . 0.0 109.661 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.45 167.76 20.61 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.186 -0.946 . . . . 0.0 109.49 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.416 0 O-C-N 119.859 -1.776 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.546 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.269 0.557 . . . . 0.0 109.584 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.46 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 17.0 mmtt -96.83 170.5 9.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.456 -0.777 . . . . 0.0 109.661 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 6' ' ' ALA . . . -103.09 151.97 18.01 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 179.919 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.496 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.0 OUTLIER -51.85 155.22 1.81 Allowed 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.177 -1.19 . . . . 0.0 110.319 -179.544 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 67.13 0.25 9.41 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 27.25 0.33 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.82 -1.4 . . . . 0.0 110.993 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER 55.79 155.32 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.926 -1.109 . . . . 0.0 110.568 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.8 p 178.84 -175.17 0.2 Allowed 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.38 -0.825 . . . . 0.0 109.974 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 38.9 t -98.68 -142.01 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.364 -0.835 . . . . 0.0 109.233 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -92.34 -62.45 1.4 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.93 -1.106 . . . . 0.0 109.546 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mp -123.11 58.87 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.28 -0.887 . . . . 0.0 109.591 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.0 mmm -81.93 -10.32 59.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.164 -0.96 . . . . 0.0 109.507 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 48.87 47.94 20.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 109.543 179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 1.2 p30 -115.74 -19.55 10.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.1 m -62.38 124.8 21.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.224 -0.922 . . . . 0.0 109.933 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.546 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.73 -25.52 66.55 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.356 0.598 . . . . 0.0 109.707 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.14 112.33 4.34 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.162 -0.961 . . . . 0.0 109.558 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.42 -146.06 16.81 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.4 m -149.02 -169.11 3.29 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -1.119 . . . . 0.0 109.446 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.461 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.9 m -81.11 108.65 14.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.506 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 24' ' ' LYS . 18.2 ttt180 -104.57 121.81 44.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.244 -0.91 . . . . 0.0 109.677 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m 52.59 20.59 1.55 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.87 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.44 -21.35 39.49 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.533 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mttp -93.67 159.64 15.12 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.197 -1.178 . . . . 0.0 109.616 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -72.05 167.93 19.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.186 -0.946 . . . . 0.0 109.632 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.496 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.304 -1.401 0 O-C-N 119.947 -1.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.536 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.302 0.572 . . . . 0.0 109.552 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -84.36 158.96 20.97 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 109.54 -179.851 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.3 162.66 17.97 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.64 149.47 14.04 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.079 -1.248 . . . . 0.0 109.667 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.84 -23.37 29.14 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.541 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.3 74.78 3.86 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.737 -0.861 . . . . 0.0 108.966 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -22.51 145.09 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.854 0.835 . . . . 0.0 112.081 -179.247 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.4 p -147.75 -166.49 2.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 110.112 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.4 t -93.92 -122.87 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.347 -0.846 . . . . 0.0 109.27 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -118.75 -61.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.719 -1.238 . . . . 0.0 109.756 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.513 ' CD2' ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -123.2 80.88 1.82 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.793 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.472 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.7 mmm -114.27 -25.33 8.5 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.187 -0.946 . . . . 0.0 109.156 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' OH ' ' CD2' ' A' ' 11' ' ' LEU . 29.1 m-85 70.29 38.13 1.48 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.357 -0.84 . . . . 0.0 109.656 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -103.33 -36.24 8.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.222 -0.924 . . . . 0.0 109.218 179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.3 m -49.53 125.72 11.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.0 109.409 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.536 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -66.65 -15.06 63.21 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 121.312 0.577 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.472 ' O ' ' O ' ' A' ' 18' ' ' GLY . 5.4 t -99.42 -144.57 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 0.0 109.125 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.472 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -50.42 -99.43 0.01 OUTLIER Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.413 ' O ' ' C ' ' A' ' 20' ' ' CYS . 21.3 p -151.54 176.07 11.69 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.078 -1.248 . . . . 0.0 109.432 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.4 m -44.28 129.1 6.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 109.303 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 1.2 ttt180 -131.47 140.93 49.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.033 -1.042 . . . . 0.0 109.491 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m 47.43 24.64 0.5 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.178 -0.951 . . . . 0.0 109.271 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.34 -23.68 17.5 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.579 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -105.57 165.61 11.03 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -1.172 . . . . 0.0 109.914 -179.774 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.27 158.36 35.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.148 -0.97 . . . . 0.0 109.467 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.445 0 O-C-N 119.991 -1.693 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.522 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 25.4 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.302 0.572 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmtm -113.21 -167.11 1.15 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.33 -0.857 . . . . 0.0 110.77 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.35 -178.01 15.19 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.93 151.23 15.09 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.084 -1.244 . . . . 0.0 109.59 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.93 -29.79 8.84 Favored Glycine 0 N--CA 1.485 1.959 0 N-CA-C 107.772 -2.131 . . . . 0.0 107.772 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.42 73.89 0.36 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.59 150.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.311 0.577 . . . . 0.0 110.371 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 23' ' ' GLY . 29.8 p -159.51 -163.57 1.2 Allowed 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.202 -0.936 . . . . 0.0 109.789 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.434 ' CB ' ' HG3' ' A' ' 12' ' ' MET . 7.7 t -94.99 -125.75 0.12 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.335 -0.853 . . . . 0.0 109.196 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -122.46 -31.38 3.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.748 -1.22 . . . . 0.0 109.748 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.37 19.72 3.99 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.434 ' HG3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -59.12 -25.42 63.82 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.959 -1.088 . . . . 0.0 108.853 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 53.28 80.57 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.87 . . . . 0.0 109.487 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' A' ' 15' ' ' CYS . 4.4 m-20 -136.35 -38.25 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.519 -0.738 . . . . 0.0 109.286 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 14' ' ' ASP . 7.6 m -43.55 124.74 3.67 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.085 0.945 . . . . 0.0 109.535 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.522 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -67.15 -24.15 65.87 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.416 0.627 . . . . 0.0 109.432 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 p -130.62 94.27 3.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.335 -0.853 . . . . 0.0 109.21 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.68 -163.69 15.43 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' CYS . 51.4 p -129.77 171.14 12.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.257 -1.143 . . . . 0.0 109.532 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.1 m -43.61 130.31 5.32 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.203 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -121.2 129.35 53.16 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.158 -0.964 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 43.7 m 48.19 22.62 0.44 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.36 -0.837 . . . . 0.0 109.586 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 102.33 -36.14 4.48 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.3 mttt -95.88 160.16 14.61 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.091 -1.241 . . . . 0.0 109.59 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.15 165.8 8.74 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.055 -1.028 . . . . 0.0 109.326 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.458 0 O-C-N 120.148 -1.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.473 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.256 0.551 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.521 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -75.81 158.45 32.16 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.216 -0.927 . . . . 0.0 110.019 -179.724 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.32 158.42 19.95 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 3' ' ' GLY . 0.0 OUTLIER -45.3 156.53 0.11 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.059 -1.26 . . . . 0.0 110.136 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 55.62 11.0 3.57 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -80.92 22.49 0.61 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.808 -1.407 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 56.41 151.33 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.07 -1.019 . . . . 0.0 110.713 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.487 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.9 p 177.73 -151.06 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 109.881 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.439 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 68.2 m -115.27 -123.48 0.29 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.375 -0.828 . . . . 0.0 109.509 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.468 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 21.7 mmm180 -118.17 -41.24 2.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.777 -1.202 . . . . 0.0 109.798 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.58 70.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.194 -0.941 . . . . 0.0 109.623 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.2 mtm -102.56 -7.63 21.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 62.68 52.6 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.61 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -126.81 -9.07 6.09 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.0 109.811 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.481 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 83.4 m -72.23 119.65 16.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 4.2 t -68.82 -13.42 62.39 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.577 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 23.2 p -122.44 2.93 9.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.881 -1.137 . . . . 0.0 111.507 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.481 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 169.01 -124.0 1.13 Allowed Glycine 0 N--CA 1.494 2.52 0 C-N-CA 118.927 -1.606 . . . . 0.0 110.491 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -132.83 -161.82 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.434 -1.039 . . . . 0.0 109.714 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.1 m -86.07 128.39 34.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.413 -0.804 . . . . 0.0 110.262 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.0 141.75 50.71 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.326 -0.859 . . . . 0.0 108.819 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.0 t 47.72 23.55 0.44 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.307 -0.87 . . . . 0.0 109.496 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.52 -33.23 5.44 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.518 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.6 mttp -96.15 171.66 8.46 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.109 -1.23 . . . . 0.0 109.806 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m -69.03 172.62 6.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 0.0 109.558 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 119.859 -1.776 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.53 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.326 0.584 . . . . 0.0 109.597 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -82.33 157.78 23.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 109.893 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.51 162.0 30.24 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.486 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.57 156.26 3.57 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.028 -1.278 . . . . 0.0 109.819 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 64.79 6.22 22.66 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.0 26.68 0.33 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.912 -1.346 . . . . 0.0 110.7 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.43 155.55 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.283 0 O-C-N 120.979 -1.076 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 16.5 p -179.2 -158.67 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.38 -0.825 . . . . 0.0 109.745 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.461 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 3.5 t -106.96 -102.37 0.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.648 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.461 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.0 ttt180 -140.23 -44.36 0.42 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.075 -1.016 . . . . 0.0 109.857 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.22 39.01 1.92 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.846 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.459 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 7.9 mmt -78.78 -22.48 46.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.074 -1.016 . . . . 0.0 109.156 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.437 ' HB2' ' O ' ' A' ' 12' ' ' MET . 38.9 m-85 60.85 73.14 0.49 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -0.871 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -134.94 9.58 3.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.322 179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.452 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 18.5 m -86.13 125.41 33.47 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.178 -0.951 . . . . 0.0 109.794 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.53 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -66.7 -23.89 66.18 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.717 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -153.18 72.04 0.93 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.16 -0.963 . . . . 0.0 109.667 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.452 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 150.99 -167.96 30.63 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.3 t -138.55 161.32 37.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -1.117 . . . . 0.0 109.299 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.3 m -52.08 127.27 21.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.324 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -139.12 121.75 16.32 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.164 -0.96 . . . . 0.0 109.816 -179.662 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.55 10.29 4.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 109.908 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.78 -2.44 33.97 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -121.99 174.48 6.88 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.045 -1.268 . . . . 0.0 109.64 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.81 170.97 14.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.62 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.343 0 O-C-N 119.919 -1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.515 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.6 mmtt -107.48 -166.75 1.18 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.247 -0.908 . . . . 0.0 109.946 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.46 160.54 25.15 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.452 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.4 pttp -53.55 152.0 5.37 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.959 -1.318 . . . . 0.0 109.451 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.03 -31.5 7.26 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 107.61 -2.196 . . . . 0.0 107.61 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.33 80.21 3.84 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.9 pttt -28.44 149.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.443 0.639 . . . . 0.0 110.739 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -150.98 -162.32 1.53 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.099 -1.001 . . . . 0.0 109.904 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.501 ' HB2' ' CG ' ' A' ' 12' ' ' MET . 73.2 m -94.07 -101.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.209 -0.932 . . . . 0.0 109.703 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -167.48 115.65 0.79 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.509 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 76.02 16.06 2.36 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.322 -0.861 . . . . 0.0 109.612 179.813 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.501 ' CG ' ' HB2' ' A' ' 9' ' ' SER . 36.4 mmt -74.17 -9.31 58.49 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.123 -0.986 . . . . 0.0 109.265 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 12' ' ' MET . 19.2 m-85 42.52 57.05 3.58 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -0.852 . . . . 0.0 109.549 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -116.55 -22.08 8.87 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.28 -0.887 . . . . 0.0 109.24 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.8 m -61.76 124.25 20.21 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.192 0.996 . . . . 0.0 109.837 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.515 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -66.9 -36.94 83.41 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.72 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 t -128.9 72.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.337 -0.852 . . . . 0.0 109.408 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.63 -158.3 26.54 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 p -148.63 168.16 23.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.101 . . . . 0.0 109.376 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 8.6 m -57.65 92.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.345 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 24' ' ' LYS . 8.8 ttm180 -103.7 135.23 45.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.325 -0.859 . . . . 0.0 109.403 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 t 58.6 22.13 9.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.247 -0.908 . . . . 0.0 109.379 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.13 -14.77 61.3 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 32.3 mttm -107.15 172.48 6.8 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.12 -1.223 . . . . 0.0 109.518 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.452 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -72.2 169.15 16.74 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.096 -1.003 . . . . 0.0 109.217 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.517 0 O-C-N 120.058 -1.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.279 0.561 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.473 ' HD2' ' HB2' ' A' ' 6' ' ' ALA . 15.4 mmtm -122.52 -167.65 1.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 109.838 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.431 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -143.72 161.88 27.74 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -41.1 148.52 0.11 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.365 -1.08 . . . . 0.0 110.107 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.97 -34.18 5.09 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 107.963 -2.055 . . . . 0.0 107.963 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.62 80.57 4.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.591 -0.946 . . . . 0.0 108.785 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -33.09 155.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.248 0.547 . . . . 0.0 110.39 -179.567 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -142.48 -145.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.032 -1.043 . . . . 0.0 109.904 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.541 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -111.95 7.16 19.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.816 -1.178 . . . . 0.0 110.351 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.541 ' CB ' ' O ' ' A' ' 9' ' ' SER . 0.0 OUTLIER 82.95 -13.62 0.8 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.638 -0.664 . . . . 0.0 109.772 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.06 22.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.044 -1.035 . . . . 0.0 109.503 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.433 ' SD ' ' CB ' ' A' ' 9' ' ' SER . 0.2 OUTLIER -83.25 -21.13 33.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.183 -0.948 . . . . 0.0 109.049 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.426 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.7 m-85 61.95 66.95 0.78 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.888 . . . . 0.0 109.837 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 15.9 p-10 -118.3 -20.25 8.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.189 -0.945 . . . . 0.0 109.257 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -60.68 127.38 31.39 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.919 0.866 . . . . 0.0 109.22 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -61.87 -41.1 97.45 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.427 HG23 ' O ' ' A' ' 17' ' ' THR . 1.3 t -131.6 120.75 23.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.409 -0.807 . . . . 0.0 108.977 179.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.18 -152.51 17.05 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.299 -1.52 . . . . 0.0 109.299 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 m -150.92 161.04 43.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.086 -1.244 . . . . 0.0 109.711 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.514 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -48.51 117.56 2.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 0.0 109.262 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.8 ttm180 -113.65 136.32 52.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.043 -1.036 . . . . 0.0 109.333 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 49.26 27.32 1.82 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 109.437 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.36 -22.22 21.06 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 7.1 mtmt -100.35 168.42 9.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.172 -1.193 . . . . 0.0 109.651 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -72.63 168.75 18.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.936 -1.102 . . . . 0.0 108.829 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.406 0 O-C-N 120.059 -1.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.543 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.395 0.617 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.518 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -71.11 159.67 34.28 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.318 -0.864 . . . . 0.0 109.603 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.517 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -105.15 168.96 16.02 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -55.73 163.12 1.47 Allowed 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.086 -1.244 . . . . 0.0 109.655 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 43.84 25.1 0.56 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.517 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -79.59 21.86 0.49 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -1.126 . . . . 0.0 111.119 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' C ' ' O ' ' A' ' 6' ' ' ALA . 12.1 pttm 34.72 43.1 0.09 Allowed 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.992 0.901 . . . . 0.0 109.624 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.64 ' N ' ' O ' ' A' ' 23' ' ' GLY . 20.7 p -68.52 -148.95 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 CA-C-O 121.44 0.638 . . . . 0.0 109.923 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.44 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 0.6 OUTLIER -106.53 -140.45 0.37 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.575 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.486 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ttp180 -132.98 116.48 16.47 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.111 -0.993 . . . . 0.0 108.889 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER 63.42 45.57 4.78 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.723 -0.61 . . . . 0.0 109.854 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 1.4 mmm -100.06 -5.37 28.11 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.379 -0.826 . . . . 0.0 109.235 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 55.07 53.4 10.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.358 -0.839 . . . . 0.0 109.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.462 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 56.2 m-20 -124.12 -28.89 3.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.268 -0.895 . . . . 0.0 109.715 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 89.2 m -44.65 125.3 4.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 109.367 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.543 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -64.38 -28.69 69.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.41 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.455 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.3 p -153.66 31.8 0.46 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.024 -1.047 . . . . 0.0 109.73 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -154.9 -159.62 9.39 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' N ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -133.97 122.91 23.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -1.074 . . . . 0.0 109.219 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' SER . 1.6 m -43.01 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.53 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -113.32 137.82 50.94 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.182 -0.948 . . . . 0.0 109.268 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.47 24.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.042 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.64 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 87.0 -21.47 19.75 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 23.7 mttt -93.09 134.07 35.62 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.839 -1.389 . . . . 0.0 109.117 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -66.54 163.97 17.55 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 121.568 -0.708 . . . . 0.0 109.526 -179.721 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.563 0 O-C-N 120.122 -1.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.537 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.318 0.58 . . . . 0.0 109.489 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -88.79 166.25 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.266 -0.896 . . . . 0.0 109.701 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -118.67 153.02 17.17 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -42.43 147.83 0.25 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -1.104 . . . . 0.0 110.02 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.97 -29.34 8.79 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.86 75.17 0.46 Allowed 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.541 -0.976 . . . . 0.0 108.529 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.574 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.26 149.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.614 0.721 . . . . 0.0 110.586 -179.611 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -152.11 -156.96 0.75 Allowed 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.213 -0.93 . . . . 0.0 109.799 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.452 ' HB3' ' HG2' ' A' ' 12' ' ' MET . 10.7 t -93.42 -110.86 0.11 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.289 -0.882 . . . . 0.0 109.52 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' OG ' ' A' ' 9' ' ' SER . 52.4 ttt180 -135.35 -45.7 0.69 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.775 -1.203 . . . . 0.0 110.024 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.16 45.57 2.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.006 -1.059 . . . . 0.0 109.951 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.452 ' HG2' ' HB3' ' A' ' 9' ' ' SER . 14.5 mmt -80.36 -36.98 33.3 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.069 -1.02 . . . . 0.0 109.058 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.42 ' HB2' ' O ' ' A' ' 12' ' ' MET . 5.0 m-30 60.16 35.24 21.13 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.43 -0.794 . . . . 0.0 109.989 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -94.96 -12.15 27.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.123 -0.985 . . . . 0.0 108.962 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.2 m -57.61 133.64 55.47 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.105 0.955 . . . . 0.0 109.607 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.537 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.0 t -66.05 -30.38 70.9 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.257 -179.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.452 ' O ' HG21 ' A' ' 17' ' ' THR . 1.7 t -142.32 81.0 1.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.952 -1.092 . . . . 0.0 109.952 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.48 -160.0 25.0 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.24 164.58 29.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.409 -1.054 . . . . 0.0 109.388 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 m -50.5 99.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -0.937 . . . . 0.0 109.521 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -112.98 145.93 39.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.139 -0.976 . . . . 0.0 109.746 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.7 t 55.31 26.33 8.49 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.443 -0.786 . . . . 0.0 109.519 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.67 -6.97 59.88 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.574 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -121.03 179.36 4.4 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.485 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.484 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.62 166.76 22.68 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.954 179.421 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.622 0 O-C-N 120.151 -1.593 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.54 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 4.1 p . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.291 0.567 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.6 mmtp -106.94 -176.77 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.21 -0.931 . . . . 0.0 110.107 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.54 163.91 12.66 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -50.25 156.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.948 -1.324 . . . . 0.0 109.19 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.66 -32.08 6.33 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -74.04 77.23 1.71 Allowed 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 178.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -30.71 150.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 121.338 0.589 . . . . 0.0 110.338 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -146.79 -166.09 2.41 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.986 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -94.31 -102.63 0.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.327 -0.858 . . . . 0.0 109.611 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.474 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.1 ttm180 -148.31 112.92 5.35 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.158 -0.964 . . . . 0.0 109.174 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.474 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.5 mt 64.01 28.25 14.34 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.445 -0.784 . . . . 0.0 109.453 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.407 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 2.5 mmt -58.74 -21.71 56.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.315 -0.866 . . . . 0.0 109.447 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.407 ' HB2' ' O ' ' A' ' 12' ' ' MET . 40.5 m-85 59.27 33.96 22.81 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.739 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -110.41 -30.48 7.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.253 -0.905 . . . . 0.0 109.241 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -54.37 124.43 15.95 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 122.214 1.007 . . . . 0.0 109.042 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.54 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.7 t -66.8 -25.09 66.29 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.759 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 18' ' ' GLY . 54.5 p -90.73 -128.84 0.09 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.237 -0.915 . . . . 0.0 109.089 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.9 -119.33 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.0 p -146.52 175.45 10.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.126 -1.22 . . . . 0.0 109.456 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.3 m -45.39 103.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.236 -0.915 . . . . 0.0 109.462 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.11 133.33 50.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 109.334 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.27 22.86 2.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.136 -0.978 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.43 -19.52 46.83 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.1 mtpt -101.22 159.46 15.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -1.162 . . . . 0.0 109.384 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.11 163.99 16.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.077 -1.014 . . . . 0.0 109.113 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.469 0 O-C-N 119.999 -1.688 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.557 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.222 0.534 . . . . 0.0 109.759 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 27.0 mmtm -81.52 -171.73 3.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.301 -0.875 . . . . 0.0 109.618 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.491 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -122.79 161.92 16.81 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -58.75 162.67 3.83 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.295 -1.121 . . . . 0.0 109.777 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.499 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 47.79 24.14 2.8 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -78.62 21.87 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.321 -1.105 . . . . 0.0 111.479 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.515 ' C ' ' O ' ' A' ' 6' ' ' ALA . 19.9 ptmt 30.79 44.65 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 121.887 0.851 . . . . 0.0 110.11 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.61 ' N ' ' O ' ' A' ' 23' ' ' GLY . 29.7 p -70.63 -153.64 0.02 OUTLIER 'General case' 0 C--N 1.29 -2.012 0 O-C-N 121.815 -0.553 . . . . 0.0 109.869 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' HA2' ' A' ' 23' ' ' GLY . 1.4 t -103.26 -140.93 0.36 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 109.868 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.544 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.6 OUTLIER -128.43 108.43 10.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.067 -1.021 . . . . 0.0 109.148 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.544 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 80.2 53.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.555 -0.716 . . . . 0.0 109.52 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.8 mmm -103.27 -16.44 15.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.944 . . . . 0.0 109.289 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 57.09 50.7 11.51 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' C ' ' A' ' 15' ' ' CYS . 1.0 OUTLIER -124.13 -27.24 3.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.717 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.456 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 64.8 m -45.47 123.08 3.92 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 122.122 0.963 . . . . 0.0 109.763 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.557 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.7 t -67.28 -9.95 45.96 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.077 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.8 p -130.2 -5.13 4.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.716 -1.24 . . . . 0.0 111.006 -178.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.456 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . -170.24 -127.84 0.97 Allowed Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.377 -1.392 . . . . 0.0 110.023 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.422 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 33.0 t -140.58 162.68 34.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.274 -1.133 . . . . 0.0 109.519 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.3 m -51.11 126.56 16.82 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.91 . . . . 0.0 109.636 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.13 123.35 40.11 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.165 -0.959 . . . . 0.0 109.061 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.75 27.45 4.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 108.765 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.61 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 91.06 -32.7 5.02 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.499 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 1.4 mttm -92.73 135.85 33.74 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.366 -1.079 . . . . 0.0 109.277 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.6 OUTLIER -57.39 165.8 1.4 Allowed 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.482 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.518 0 O-C-N 120.053 -1.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.544 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.466 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 2.5 mptt -81.84 161.7 23.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.324 -0.86 . . . . 0.0 110.115 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -109.19 161.68 13.03 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 108.812 -1.715 . . . . 0.0 108.812 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.482 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -41.37 150.47 0.09 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.289 -1.124 . . . . 0.0 109.926 -179.615 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 96.22 -31.57 7.26 Favored Glycine 0 N--CA 1.487 2.069 0 N-CA-C 107.881 -2.087 . . . . 0.0 107.881 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.11 75.89 0.34 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -28.93 150.09 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.399 0.619 . . . . 0.0 110.475 -179.418 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.9 p -157.16 -161.67 1.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.136 -0.978 . . . . 0.0 109.735 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 86.9 p -98.84 -143.72 0.32 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.296 -0.877 . . . . 0.0 109.425 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -30.22 18.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.0 109.445 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.3 mt -153.84 44.07 0.58 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.177 -0.952 . . . . 0.0 109.956 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -53.31 -23.68 9.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.065 -1.022 . . . . 0.0 109.162 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 12' ' ' MET . 10.7 m-85 63.67 36.1 11.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.622 179.254 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.03 -25.47 5.77 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.087 -1.008 . . . . 0.0 109.304 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.8 m -52.93 126.21 19.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.987 . . . . 0.0 109.157 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.544 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.87 -28.04 68.01 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.349 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.98 135.65 47.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.066 -1.021 . . . . 0.0 109.719 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.26 -176.29 3.89 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.26 -171.83 1.94 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.28 -1.129 . . . . 0.0 109.47 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 9' ' ' SER . 9.0 m -61.37 103.34 0.3 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.303 -0.873 . . . . 0.0 109.446 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . 28.6 tpt180 -97.81 135.72 39.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 t 51.5 32.52 8.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.278 -0.889 . . . . 0.0 109.718 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.27 -9.7 46.59 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.554 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -110.94 172.02 7.12 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.015 -1.286 . . . . 0.0 109.552 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m -73.26 168.58 18.87 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.46 -0.896 . . . . 0.0 108.839 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.074 -1.641 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.548 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 7.5 p . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 121.303 0.573 . . . . 0.0 109.535 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.481 ' HD2' ' HB3' ' A' ' 6' ' ' ALA . 16.5 mmtt -99.04 168.96 9.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 109.91 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.45 169.43 20.47 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.401 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.02 156.97 13.68 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.177 -1.19 . . . . 0.0 110.102 -179.548 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.436 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 70.9 -0.87 26.94 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.06 22.03 0.54 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.971 -1.311 . . . . 0.0 110.963 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.88 154.17 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.941 -1.099 . . . . 0.0 110.46 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.485 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 30.9 p 175.14 173.95 0.23 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.482 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -93.33 -163.36 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.1 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.438 HH11 ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -60.61 -61.44 2.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.031 -1.043 . . . . 0.0 109.519 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' CZ ' ' A' ' 13' ' ' TYR . 2.6 mp -138.04 72.63 1.42 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.274 -0.891 . . . . 0.0 109.614 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.493 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -86.57 -14.9 41.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.105 -0.997 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.493 ' CD2' ' O ' ' A' ' 12' ' ' MET . 3.9 m-85 69.29 54.73 0.41 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -130.23 -11.19 4.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.136 -0.977 . . . . 0.0 110.134 -179.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.1 m -73.15 124.62 25.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.118 -0.989 . . . . 0.0 109.882 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.548 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -67.09 -27.4 67.32 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 121.369 0.604 . . . . 0.0 109.42 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -150.91 126.85 10.39 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.261 -0.899 . . . . 0.0 109.281 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.26 -166.93 28.61 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.07 -167.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -1.147 . . . . 0.0 109.673 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.482 ' SG ' ' O ' ' A' ' 9' ' ' SER . 6.9 m -85.43 117.38 24.31 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.361 -0.837 . . . . 0.0 109.728 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -122.67 131.01 53.61 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.167 -0.958 . . . . 0.0 109.268 179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 57.41 28.18 15.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.294 -0.879 . . . . 0.0 109.208 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.93 7.63 88.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.522 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 10.5 mtpt -120.26 162.34 19.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.191 -1.182 . . . . 0.0 110.0 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.401 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m -73.63 167.58 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.462 -0.774 . . . . 0.0 109.301 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.392 0 O-C-N 119.923 -1.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.533 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -111.15 168.62 9.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.86 . . . . 0.0 109.976 -179.629 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.2 165.17 25.06 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.8 153.55 24.17 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.094 -1.239 . . . . 0.0 110.109 -179.706 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.71 2.73 12.47 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.12 28.64 0.29 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.825 -1.397 . . . . 0.0 110.902 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.56 157.04 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.893 -1.13 . . . . 0.0 110.358 -179.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.2 p 179.23 -174.06 0.2 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.432 -0.793 . . . . 0.0 109.961 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.2 t -94.48 -118.52 0.1 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.248 -0.907 . . . . 0.0 109.404 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.511 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -119.86 -76.65 0.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.915 -1.116 . . . . 0.0 109.679 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -111.76 28.51 8.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.054 -1.029 . . . . 0.0 109.756 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.456 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mmt -59.09 -22.65 61.15 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.295 -0.878 . . . . 0.0 109.204 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 12' ' ' MET . 4.0 m-85 62.76 56.61 1.9 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.405 -0.81 . . . . 0.0 109.845 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.425 ' O ' ' C ' ' A' ' 15' ' ' CYS . 75.2 m-20 -114.38 -37.94 4.21 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 28.4 m -44.1 125.03 4.2 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 109.544 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.533 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.2 t -66.81 -10.09 44.1 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.936 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 18' ' ' GLY . 17.6 p -146.21 -106.65 0.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.891 . . . . 0.0 109.556 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -43.82 167.16 0.02 OUTLIER Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 p -94.94 -168.85 1.88 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.204 -1.174 . . . . 0.0 109.614 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.0 m -81.92 117.52 22.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.315 -0.865 . . . . 0.0 109.792 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.27 113.44 26.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.129 -0.982 . . . . 0.0 109.324 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 16.35 2.01 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.686 -0.634 . . . . 0.0 109.804 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 112.18 -19.11 22.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.51 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.1 mtpp -93.48 151.92 19.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.099 -1.236 . . . . 0.0 109.637 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.32 168.04 20.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 109.55 179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.546 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.5 p . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.354 0.597 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.537 ' HA ' ' CE ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -90.48 -169.4 2.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.534 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -121.18 153.2 16.67 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 6' ' ' ALA . 1.2 ttmt -48.84 152.77 0.95 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.935 -1.332 . . . . 0.0 109.958 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.42 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 45.95 18.03 0.23 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -81.36 26.17 0.47 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.318 . . . . 0.0 110.715 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.77 157.9 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.042 -1.036 . . . . 0.0 110.284 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.45 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 15.5 p -179.48 -157.64 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.352 -0.842 . . . . 0.0 110.115 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.85 -89.27 0.58 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.402 -0.811 . . . . 0.0 109.739 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.52 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -141.41 -118.72 0.11 Allowed 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.421 -0.799 . . . . 0.0 109.861 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.561 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 3.8 mm? -79.01 52.9 1.33 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.737 -1.227 . . . . 0.0 110.02 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.7 mmm -75.78 -13.14 60.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.134 -0.979 . . . . 0.0 109.003 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.43 ' CE1' HD13 ' A' ' 11' ' ' LEU . 23.8 m-85 53.32 47.02 25.17 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.393 -0.817 . . . . 0.0 109.968 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' CYS . 12.7 t0 -110.87 -30.04 7.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 109.235 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 19' ' ' SER . 74.4 m -43.58 124.19 3.44 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.093 0.949 . . . . 0.0 109.404 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.546 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.77 -22.99 66.02 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.522 ' O ' ' CG2' ' A' ' 17' ' ' THR . 10.4 t -153.96 54.5 0.71 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.967 . . . . 0.0 109.746 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 167.39 -147.51 11.86 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 26' ' ' NH2 . 28.3 t -146.26 -162.8 1.6 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.337 -1.096 . . . . 0.0 109.526 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.461 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.0 m -94.43 105.3 17.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.744 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.408 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.7 OUTLIER -119.38 131.89 55.75 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.203 -0.935 . . . . 0.0 109.061 179.665 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' SER . . . . . 0.408 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 22.7 t 62.5 14.82 7.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.323 -0.861 . . . . 0.0 109.322 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.441 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.16 -23.87 34.29 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.535 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.2 mtmm -100.55 170.16 8.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.21 -1.171 . . . . 0.0 109.934 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.37 167.16 15.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.549 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.499 ' N ' ' O ' ' A' ' 19' ' ' SER . . . . . . . . 0 C--N 1.302 -1.48 0 O-C-N 120.066 -1.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.546 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.388 0.613 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 2.7 mptp? -84.84 -174.97 5.56 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.0 109.843 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.21 169.56 14.91 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.464 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.7 mtpt -57.21 150.75 17.03 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.103 -1.233 . . . . 0.0 109.959 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.36 -4.87 38.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.9 25.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.245 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.62 157.59 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 O-C-N 120.941 -1.099 . . . . 0.0 110.884 179.835 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.456 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.0 p -179.9 -157.47 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.438 -0.789 . . . . 0.0 109.789 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.464 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 0.3 OUTLIER -116.78 -82.79 0.63 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.924 . . . . 0.0 109.548 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.523 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -156.96 -66.65 0.1 Allowed 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.428 -0.795 . . . . 0.0 109.902 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.443 HD12 ' HB3' ' A' ' 10' ' ' ARG . 2.3 mp -107.51 24.58 12.67 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.094 -1.004 . . . . 0.0 109.955 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.464 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 0.0 OUTLIER -57.25 -26.64 61.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.171 -0.956 . . . . 0.0 108.9 179.536 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 49.32 33.44 5.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.495 -0.753 . . . . 0.0 110.073 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.52 -24.56 16.01 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.122 -0.986 . . . . 0.0 108.924 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 m -51.84 125.07 14.1 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 122.19 0.995 . . . . 0.0 109.568 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.546 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.4 t -67.0 -12.56 60.21 Favored 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.6 p -106.07 -122.23 0.23 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.219 -0.926 . . . . 0.0 109.745 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.21 -129.58 0.08 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -120.85 -171.68 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.276 -1.132 . . . . 0.0 109.7 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.42 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.8 m -63.22 155.24 28.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.684 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -146.08 124.46 12.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.333 -0.855 . . . . 0.0 109.334 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.1 m 52.1 24.61 2.79 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.846 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.452 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.13 -24.24 32.69 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.527 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.3 mttt -93.95 177.39 6.0 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.048 -1.266 . . . . 0.0 109.544 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.464 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -73.3 -176.89 2.35 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.579 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.364 0 O-C-N 119.9 -1.75 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.544 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.294 0.568 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -113.68 168.53 9.69 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.274 -0.891 . . . . 0.0 109.552 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.41 154.35 17.14 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.473 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -55.33 155.42 5.13 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.967 -1.313 . . . . 0.0 109.748 -179.765 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.5 -13.32 11.86 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.524 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.16 37.74 0.33 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.82 -1.4 . . . . 0.0 111.097 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 mttp 50.57 167.94 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.474 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.5 p 179.17 -175.54 0.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.076 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.466 ' O ' ' HD3' ' A' ' 10' ' ' ARG . 2.9 m -105.26 -103.74 0.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.355 -0.84 . . . . 0.0 109.514 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.466 ' HD3' ' O ' ' A' ' 9' ' ' SER . 3.2 mmt180 -128.26 -106.99 0.3 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.038 -1.039 . . . . 0.0 109.592 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.55 70.01 3.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.736 -1.228 . . . . 0.0 109.606 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 19.2 mmt -97.66 -31.71 12.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -0.906 . . . . 0.0 109.547 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' CB ' ' O ' ' A' ' 12' ' ' MET . 3.1 m-85 77.56 40.91 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.5 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' OD2' ' HB2' ' A' ' 12' ' ' MET . 2.9 m-20 -96.48 -25.47 15.65 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.133 -0.979 . . . . 0.0 109.236 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.458 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 33.2 m -55.54 127.03 27.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.218 -0.926 . . . . 0.0 109.776 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.544 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -65.76 -30.58 71.26 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.542 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.463 HG21 ' O ' ' A' ' 16' ' ' CYS . 1.2 p -150.55 37.49 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.003 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.458 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -164.94 -155.52 8.52 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 p -147.93 167.91 23.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.35 -1.088 . . . . 0.0 109.047 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 1.6 m -56.03 125.06 19.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.105 -0.997 . . . . 0.0 109.215 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -121.2 100.22 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.173 -0.954 . . . . 0.0 109.689 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.98 2.21 3.48 Favored 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.84 -0.538 . . . . 0.0 110.316 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.458 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 137.74 -30.24 2.59 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 119.587 -1.292 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.532 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -102.73 177.31 4.89 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.995 -1.297 . . . . 0.0 109.998 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.473 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -74.56 168.51 19.63 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.421 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.448 0 O-C-N 119.939 -1.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.544 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.396 0.617 . . . . 0.0 109.609 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -104.61 165.09 11.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.901 . . . . 0.0 109.759 -179.775 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.43 165.0 16.66 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -59.96 150.08 30.01 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.123 -1.222 . . . . 0.0 110.389 -179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.457 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 57.14 9.05 3.76 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.77 27.68 0.37 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.727 -1.454 . . . . 0.0 110.647 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.72 154.46 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 O-C-N 121.039 -1.038 . . . . 0.0 110.894 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 14.9 p -178.71 -158.19 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.8 p -98.0 -131.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.366 -0.834 . . . . 0.0 109.496 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.447 ' O ' ' CG ' ' A' ' 11' ' ' LEU . 65.9 mtm180 -134.63 -0.5 2.88 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.786 -1.196 . . . . 0.0 110.382 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.447 ' CG ' ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -174.44 35.12 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.785 -1.197 . . . . 0.0 110.566 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.422 ' CB ' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -91.22 -19.57 22.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.17 -0.956 . . . . 0.0 108.793 179.25 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.1 m-85 61.61 57.92 2.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.468 -0.77 . . . . 0.0 110.253 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.422 ' OD1' ' CB ' ' A' ' 12' ' ' MET . 0.8 OUTLIER -106.82 -11.05 15.86 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.224 -0.922 . . . . 0.0 109.014 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 72.8 m -57.82 125.76 24.45 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 122.05 0.929 . . . . 0.0 110.026 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.544 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.9 t -57.96 -33.01 68.39 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.967 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -143.27 -22.03 0.62 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.06 -1.025 . . . . 0.0 111.276 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.488 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -101.69 -148.33 21.2 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 26' ' ' NH2 . 66.1 p -140.25 -174.17 3.87 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.426 -1.044 . . . . 0.0 108.994 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 m -91.78 96.18 10.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.02 -1.05 . . . . 0.0 109.395 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 143.78 50.67 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 65.2 28.61 12.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.284 -0.885 . . . . 0.0 109.578 -180.0 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.99 11.65 67.04 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.548 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.2 mtmm -140.83 173.3 11.62 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.32 165.33 25.26 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.101 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.509 ' N ' ' O ' ' A' ' 19' ' ' SER . . . . . . . . 0 C--N 1.299 -1.605 0 O-C-N 120.063 -1.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.522 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.269 0.556 . . . . 0.0 109.515 . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 11.7 mmtt -95.11 -172.4 2.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.387 -0.821 . . . . 0.0 109.962 -179.51 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.439 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -139.73 157.54 25.28 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.489 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -43.65 152.05 0.17 Allowed 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.294 -1.121 . . . . 0.0 109.699 -179.856 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.18 -30.27 6.45 Favored Glycine 0 N--CA 1.485 1.955 0 N-CA-C 108.245 -1.942 . . . . 0.0 108.245 -179.055 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.07 76.19 3.63 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.459 -1.024 . . . . 0.0 108.533 179.248 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.47 153.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.177 0.513 . . . . 0.0 110.222 -179.652 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 24.6 p -144.28 -160.48 1.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.071 -1.018 . . . . 0.0 109.518 -179.555 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.02 -83.7 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.127 -0.983 . . . . 0.0 109.459 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -175.18 105.82 0.09 Allowed 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.469 -0.77 . . . . 0.0 109.64 -179.975 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 70.06 44.33 0.8 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.328 -0.858 . . . . 0.0 109.899 179.807 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.443 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 13.5 mmm -90.52 -15.61 30.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 109.0 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 55.62 59.29 3.94 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.726 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.443 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 5.1 m-20 -124.21 -30.18 3.48 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.194 -0.941 . . . . 0.0 109.523 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.466 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 12.2 m -49.56 125.0 10.46 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 122.066 0.936 . . . . 0.0 109.348 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.522 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.5 t -66.77 -14.65 62.85 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.125 -179.558 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 t -119.71 31.73 6.41 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.085 -1.009 . . . . 0.0 109.862 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 141.98 -150.89 22.42 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 179.771 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 20' ' ' CYS . 7.5 p -124.16 175.88 6.74 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.364 -1.08 . . . . 0.0 109.288 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 19' ' ' SER . 16.8 m -44.58 147.11 0.63 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.205 -0.934 . . . . 0.0 109.62 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.1 ttt180 -123.6 100.8 6.98 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -0.822 . . . . 0.0 108.841 179.377 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 p 59.89 12.89 3.29 Favored 'General case' 0 C--N 1.292 -1.903 0 O-C-N 121.801 -0.562 . . . . 0.0 110.045 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.46 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 127.92 -37.71 2.25 Favored Glycine 0 N--CA 1.493 2.457 0 C-N-CA 119.803 -1.189 . . . . 0.0 110.241 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.594 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -103.07 162.59 12.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.1 -1.235 . . . . 0.0 109.86 -179.509 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.489 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -67.16 165.32 16.24 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.823 -1.173 . . . . 0.0 109.012 179.799 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.53 0 O-C-N 120.173 -1.579 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.533 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -116.36 -167.49 1.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.195 -0.94 . . . . 0.0 110.332 -179.015 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.02 161.46 25.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.463 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -59.53 152.78 21.12 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.421 . . . . 0.0 109.37 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.58 -34.73 4.68 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 107.311 -2.316 . . . . 0.0 107.311 -178.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.39 83.33 3.83 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.67 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.57 152.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.361 0.6 . . . . 0.0 110.527 -179.549 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -156.95 -156.18 0.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.02 -1.05 . . . . 0.0 109.848 -179.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -93.73 -137.29 0.2 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 -179.754 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.483 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 2.6 mtp180 -134.77 112.79 11.02 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 120.923 -1.11 . . . . 0.0 109.191 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.483 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.6 mp 63.64 65.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.618 -0.676 . . . . 0.0 109.564 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.465 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -116.68 -16.62 10.68 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.417 -0.802 . . . . 0.0 109.23 179.828 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.465 ' HB2' ' O ' ' A' ' 12' ' ' MET . 18.0 m-85 66.26 43.84 2.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -0.856 . . . . 0.0 109.889 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.461 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 11.8 m-20 -110.83 -34.04 6.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.179 -0.951 . . . . 0.0 109.465 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 27.2 m -52.45 124.22 12.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.142 -0.974 . . . . 0.0 109.207 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.533 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.34 -24.28 66.5 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.656 -179.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.99 83.75 2.0 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.305 -0.872 . . . . 0.0 109.491 179.903 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.88 -154.76 16.71 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 t -147.44 158.0 43.8 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.245 -1.15 . . . . 0.0 109.488 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 19.7 m -45.75 103.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.837 . . . . 0.0 109.382 -179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . 38.9 ttp180 -111.9 136.04 51.72 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.093 -1.004 . . . . 0.0 109.453 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.21 14.3 4.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.368 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.31 -23.49 35.1 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -104.65 176.38 5.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.172 -1.193 . . . . 0.0 109.798 -179.914 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -73.06 170.33 15.11 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.326 -0.95 . . . . 0.0 109.004 179.792 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.493 0 O-C-N 120.083 -1.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.542 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -106.07 173.85 6.14 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.218 -0.926 . . . . 0.0 109.655 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -122.81 155.95 17.21 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 2.0 ttmt -41.88 150.82 0.11 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 121.283 -1.128 . . . . 0.0 109.815 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.77 -31.47 6.17 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 108.064 -2.015 . . . . 0.0 108.064 -179.105 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -71.98 75.83 0.92 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.554 -0.968 . . . . 0.0 108.563 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.38 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.223 0.535 . . . . 0.0 110.346 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -148.63 -168.27 3.05 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.017 -1.052 . . . . 0.0 110.09 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.62 -88.97 0.22 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.773 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HB3' HD23 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -148.52 -74.74 0.18 Allowed 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.505 -0.747 . . . . 0.0 109.528 -179.585 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.551 ' N ' ' CD2' ' A' ' 11' ' ' LEU . 3.6 mm? -108.87 33.74 4.07 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.718 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -20.6 66.17 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.148 -0.97 . . . . 0.0 109.336 179.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 57.2 65.92 1.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.854 . . . . 0.0 109.703 179.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.77 -32.35 2.36 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.213 -0.929 . . . . 0.0 109.612 179.87 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -56.67 126.9 28.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.931 . . . . 0.0 109.259 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.542 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.0 t -66.37 -33.92 76.8 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.235 0.54 . . . . 0.0 109.583 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.67 130.82 56.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 109.354 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 58.72 -166.41 7.44 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.431 -1.467 . . . . 0.0 109.431 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' C ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.41 179.65 4.24 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.226 -1.161 . . . . 0.0 109.482 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.408 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.3 m -43.76 130.2 5.55 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.352 -0.843 . . . . 0.0 109.258 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.4 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -127.91 123.09 34.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.29 179.913 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.71 24.4 14.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.242 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.65 -19.65 39.62 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.1 mttm -109.26 171.9 7.16 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.108 -1.231 . . . . 0.0 109.346 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.484 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m -73.06 164.87 26.05 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 119.309 -0.957 . . . . 0.0 109.031 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.444 0 O-C-N 120.042 -1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.502 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.387 0.613 . . . . 0.0 109.544 . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.8 mmtt -88.74 -178.8 5.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 109.877 -179.523 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -135.3 169.43 23.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp -47.3 148.92 1.14 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 120.924 -1.339 . . . . 0.0 109.615 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 93.21 -33.18 5.23 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 107.831 -2.107 . . . . 0.0 107.831 -178.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -70.38 75.25 0.54 Allowed 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 4.0 ptmt -31.76 151.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.451 0.643 . . . . 0.0 110.249 -179.079 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.06 -164.24 1.65 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.17 -0.956 . . . . 0.0 109.542 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -94.06 -164.76 1.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 109.233 179.99 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -75.72 -25.5 56.67 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.085 -1.01 . . . . 0.0 109.177 179.727 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.574 HD22 ' CZ ' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -156.63 91.05 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 0.0 109.393 179.75 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.534 ' C ' ' CD2' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -114.98 -15.02 11.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.245 -0.909 . . . . 0.0 109.295 -179.866 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.574 ' CZ ' HD22 ' A' ' 11' ' ' LEU . 1.5 m-85 55.79 30.66 16.14 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.875 . . . . 0.0 109.591 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . 0.428 ' CG ' ' HB3' ' A' ' 12' ' ' MET . 3.3 p30 -101.86 -31.15 10.86 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.166 -0.959 . . . . 0.0 109.345 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -54.67 124.5 16.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.108 -0.995 . . . . 0.0 108.918 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.502 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -66.29 -30.87 71.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 121.354 0.597 . . . . 0.0 109.484 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -130.96 128.06 39.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.306 -0.872 . . . . 0.0 109.393 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.45 -151.75 34.91 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.38 -157.67 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -1.155 . . . . 0.0 109.621 -179.963 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 9' ' ' SER . 21.8 m -86.09 96.7 9.96 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 109.529 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 24.8 ttp180 -95.04 139.35 31.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.046 -1.034 . . . . 0.0 109.786 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.9 m 53.63 20.63 2.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -0.01 81.92 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.556 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.9 mtmm -118.52 164.91 14.59 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.139 -1.212 . . . . 0.0 109.882 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.21 164.91 23.27 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.299 -0.96 . . . . 0.0 108.782 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.514 0 O-C-N 119.829 -1.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' CYS . . . . . 0.572 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.42 0.629 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.541 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -82.52 162.68 21.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.334 -0.854 . . . . 0.0 109.668 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.66 160.08 18.19 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.964 -1.655 . . . . 0.0 108.964 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.492 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -50.98 146.78 5.71 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.161 -1.199 . . . . 0.0 110.715 -179.401 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.463 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 71.51 -10.92 3.43 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 179.136 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.67 36.69 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.576 -1.543 . . . . 0.0 111.392 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 51.67 161.19 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.122 -0.987 . . . . 0.0 110.988 179.731 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' GLY . 24.4 p 179.05 -167.0 0.07 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.237 -0.914 . . . . 0.0 109.665 179.926 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.525 ' CB ' ' HB2' ' A' ' 12' ' ' MET . 0.3 OUTLIER -93.73 -161.8 0.88 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.426 -0.797 . . . . 0.0 109.234 -179.95 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -91.74 -32.58 15.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.031 -1.043 . . . . 0.0 108.9 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.2 mp -153.18 22.37 0.56 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' MET . . . . . 0.525 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 57.2 tpp -62.56 -17.74 60.61 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.3 m-85 63.27 49.03 3.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.471 -0.768 . . . . 0.0 110.344 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.75 -21.31 15.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 0.0 108.548 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.2 m -56.23 125.59 22.45 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 122.038 0.923 . . . . 0.0 109.264 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.572 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.1 -34.89 79.1 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.595 -179.759 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.485 ' CG2' ' O ' ' A' ' 17' ' ' THR . 9.7 t -154.56 89.89 1.29 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.35 -0.844 . . . . 0.0 109.346 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 151.85 -149.77 21.54 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 m -139.31 178.33 7.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.165 -1.197 . . . . 0.0 109.458 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.8 m -95.68 106.92 19.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.885 . . . . 0.0 109.729 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -118.06 135.84 53.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.484 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.26 28.81 4.45 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.323 -0.86 . . . . 0.0 109.681 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 80.02 -5.98 60.84 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.584 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 17.7 mttm -100.55 146.15 27.46 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.329 -1.1 . . . . 0.0 109.156 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.492 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -71.96 172.53 9.83 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.163 -0.961 . . . . 0.0 109.146 -179.832 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' NH2 . . . . . 0.421 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.911 -1.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.343 0.592 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.541 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -96.52 162.81 13.31 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.22 -0.925 . . . . 0.0 110.032 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -107.12 161.66 13.69 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HE2' ' NH1' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -43.56 159.81 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.178 -1.189 . . . . 0.0 109.819 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.03 12.13 10.58 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.88 16.52 1.15 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.074 -1.251 . . . . 0.0 110.625 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER 56.33 154.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.207 -0.933 . . . . 0.0 110.479 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.3 p 178.38 -147.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.577 -0.702 . . . . 0.0 109.504 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.435 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.9 OUTLIER -137.28 -142.52 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.163 -0.961 . . . . 0.0 109.396 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 24.6 tpt180 -112.26 100.59 8.93 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.059 -1.026 . . . . 0.0 109.155 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 83.96 77.28 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.419 0.628 . . . . 0.0 109.842 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.498 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 10.3 mmt -125.11 -40.39 2.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.87 . . . . 0.0 108.815 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.2 m-85 70.69 52.51 0.31 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.496 -0.753 . . . . 0.0 110.942 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.498 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -116.76 -23.85 7.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 108.621 178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 38.7 m -50.79 126.88 16.97 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.897 0.856 . . . . 0.0 109.605 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.563 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 4.1 t -58.22 -27.38 63.87 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.217 0.532 . . . . 0.0 109.638 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' A' ' 17' ' ' THR . 5.1 t -154.34 75.55 1.0 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.214 -0.929 . . . . 0.0 109.698 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 149.5 -167.16 29.71 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.6 m -127.37 -164.55 1.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -1.163 . . . . 0.0 109.715 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.7 m -79.43 116.34 19.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -114.79 115.79 27.57 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.284 -0.885 . . . . 0.0 109.457 179.458 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 66.04 33.94 7.29 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.433 -0.792 . . . . 0.0 110.12 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -11.38 59.87 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 21' ' ' ARG . 12.1 mttt -115.43 -175.55 2.73 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.099 -1.236 . . . . 0.0 109.371 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.463 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.539 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.21 0.529 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.2 mptm? -83.52 157.67 22.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 109.96 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -90.46 157.95 26.06 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -49.46 157.88 0.47 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.123 -1.222 . . . . 0.0 110.234 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.56 7.48 15.27 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.26 24.75 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.021 -1.281 . . . . 0.0 110.833 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.41 156.17 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.063 -1.023 . . . . 0.0 110.598 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 22.1 p 177.47 -165.57 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.548 -0.72 . . . . 0.0 109.745 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.437 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 8.4 t -101.53 -145.14 0.35 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.395 -0.816 . . . . 0.0 109.295 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.461 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -95.0 -24.22 17.03 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.099 -1.001 . . . . 0.0 109.7 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 1.014 HD23 ' OH ' ' A' ' 13' ' ' TYR . 2.7 mp -133.08 -105.91 0.25 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.9 OUTLIER 67.41 -58.16 0.43 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.895 -1.128 . . . . 0.0 109.846 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 1.014 ' OH ' HD23 ' A' ' 11' ' ' LEU . 42.8 m-85 71.02 45.49 0.51 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.434 -0.791 . . . . 0.0 109.725 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 3.3 m-20 -104.23 -20.76 13.68 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.111 -0.993 . . . . 0.0 109.231 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.5 m -47.42 127.11 10.64 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.814 . . . . 0.0 109.532 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.539 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 5.0 t -66.18 -13.15 59.78 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.395 0.617 . . . . 0.0 109.522 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.11 117.64 4.62 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.405 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.33 -153.12 24.96 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 31.7 t -137.09 -158.96 0.91 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.195 -1.18 . . . . 0.0 109.56 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 6.3 m -83.0 114.71 21.45 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.244 -0.91 . . . . 0.0 109.647 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 23.4 mtp180 -104.57 117.46 34.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.1 -1.0 . . . . 0.0 109.488 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.462 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 3.1 m 59.84 13.49 3.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.506 -0.747 . . . . 0.0 109.837 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.447 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 111.83 -24.12 15.64 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.2 mtmt -96.03 169.36 10.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -1.162 . . . . 0.0 109.661 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.421 0 O-C-N 121.186 -0.946 . . . . 0.0 109.49 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.568 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.269 0.557 . . . . 0.0 109.584 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 17.0 mmtt -96.83 170.5 9.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.456 -0.777 . . . . 0.0 109.661 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.09 151.97 18.01 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -51.85 155.22 1.81 Allowed 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.177 -1.19 . . . . 0.0 110.319 -179.544 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 67.13 0.25 9.41 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 27.25 0.33 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.82 -1.4 . . . . 0.0 110.993 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER 55.79 155.32 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.926 -1.109 . . . . 0.0 110.568 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.8 p 178.84 -175.17 0.2 Allowed 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.38 -0.825 . . . . 0.0 109.974 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 38.9 t -98.68 -142.01 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.364 -0.835 . . . . 0.0 109.233 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -92.34 -62.45 1.4 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.93 -1.106 . . . . 0.0 109.546 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.421 HD23 ' OH ' ' A' ' 13' ' ' TYR . 1.4 mp -123.11 58.87 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.28 -0.887 . . . . 0.0 109.591 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.0 mmm -81.93 -10.32 59.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.164 -0.96 . . . . 0.0 109.507 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.421 ' OH ' HD23 ' A' ' 11' ' ' LEU . 93.0 m-85 48.87 47.94 20.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 109.543 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 1.2 p30 -115.74 -19.55 10.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.1 m -62.38 124.8 21.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.224 -0.922 . . . . 0.0 109.933 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.73 -25.52 66.55 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.356 0.598 . . . . 0.0 109.707 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.14 112.33 4.34 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.162 -0.961 . . . . 0.0 109.558 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.42 -146.06 16.81 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.4 m -149.02 -169.11 3.29 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -1.119 . . . . 0.0 109.446 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.461 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.9 m -81.11 108.65 14.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.506 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 24' ' ' LYS . 18.2 ttt180 -104.57 121.81 44.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.244 -0.91 . . . . 0.0 109.677 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m 52.59 20.59 1.55 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.87 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.44 -21.35 39.49 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mttp -93.67 159.64 15.12 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.197 -1.178 . . . . 0.0 109.616 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.494 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.186 -0.946 . . . . 0.0 109.632 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.302 0.572 . . . . 0.0 109.552 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -84.36 158.96 20.97 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 109.54 -179.851 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.3 162.66 17.97 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HD2' HG21 ' A' ' 17' ' ' THR . 0.0 OUTLIER -55.64 149.47 14.04 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.079 -1.248 . . . . 0.0 109.667 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.84 -23.37 29.14 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.541 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.3 74.78 3.86 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.737 -0.861 . . . . 0.0 108.966 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -22.51 145.09 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.854 0.835 . . . . 0.0 112.081 -179.247 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.4 p -147.75 -166.49 2.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 110.112 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.4 t -93.92 -122.87 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.347 -0.846 . . . . 0.0 109.27 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.487 ' HG3' HD12 ' A' ' 11' ' ' LEU . 0.9 OUTLIER -118.75 -61.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.719 -1.238 . . . . 0.0 109.756 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.643 HD23 ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -123.2 80.88 1.82 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.793 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.7 mmm -114.27 -25.33 8.5 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.187 -0.946 . . . . 0.0 109.156 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.643 ' OH ' HD23 ' A' ' 11' ' ' LEU . 29.1 m-85 70.29 38.13 1.48 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.357 -0.84 . . . . 0.0 109.656 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB2' ' HE2' ' A' ' 2' ' ' LYS . 1.1 p30 -103.33 -36.24 8.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.222 -0.924 . . . . 0.0 109.218 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.3 m -49.53 125.72 11.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.0 109.409 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -66.65 -15.06 63.21 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 121.312 0.577 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.474 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 5.4 t -99.42 -144.57 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 0.0 109.125 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.474 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -50.42 -99.43 0.01 OUTLIER Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.413 ' O ' ' C ' ' A' ' 20' ' ' CYS . 21.3 p -151.54 176.07 11.69 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.078 -1.248 . . . . 0.0 109.432 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.4 m -44.28 129.1 6.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 109.303 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 1.2 ttt180 -131.47 140.93 49.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.033 -1.042 . . . . 0.0 109.491 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m 47.43 24.64 0.5 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.178 -0.951 . . . . 0.0 109.271 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.34 -23.68 17.5 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -105.57 165.61 11.03 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -1.172 . . . . 0.0 109.914 -179.774 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.148 -0.97 . . . . 0.0 109.467 -179.946 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.53 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 25.4 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.302 0.572 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmtm -113.21 -167.11 1.15 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.33 -0.857 . . . . 0.0 110.77 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.35 -178.01 15.19 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.93 151.23 15.09 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.084 -1.244 . . . . 0.0 109.59 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.93 -29.79 8.84 Favored Glycine 0 N--CA 1.485 1.959 0 N-CA-C 107.772 -2.131 . . . . 0.0 107.772 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.42 73.89 0.36 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.59 150.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.311 0.577 . . . . 0.0 110.371 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 23' ' ' GLY . 29.8 p -159.51 -163.57 1.2 Allowed 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.202 -0.936 . . . . 0.0 109.789 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.459 ' CB ' ' HG3' ' A' ' 12' ' ' MET . 7.7 t -94.99 -125.75 0.12 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.335 -0.853 . . . . 0.0 109.196 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -122.46 -31.38 3.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.748 -1.22 . . . . 0.0 109.748 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.37 19.72 3.99 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.459 ' HG3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -59.12 -25.42 63.82 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.959 -1.088 . . . . 0.0 108.853 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 53.28 80.57 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.87 . . . . 0.0 109.487 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' A' ' 15' ' ' CYS . 4.4 m-20 -136.35 -38.25 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.519 -0.738 . . . . 0.0 109.286 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 14' ' ' ASP . 7.6 m -43.55 124.74 3.67 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.085 0.945 . . . . 0.0 109.535 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.53 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -67.15 -24.15 65.87 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.416 0.627 . . . . 0.0 109.432 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 p -130.62 94.27 3.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.335 -0.853 . . . . 0.0 109.21 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.68 -163.69 15.43 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' CYS . 51.4 p -129.77 171.14 12.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.257 -1.143 . . . . 0.0 109.532 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.1 m -43.61 130.31 5.32 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.203 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -121.2 129.35 53.16 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.158 -0.964 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 43.7 m 48.19 22.62 0.44 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.36 -0.837 . . . . 0.0 109.586 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 102.33 -36.14 4.48 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.3 mttt -95.88 160.16 14.61 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.091 -1.241 . . . . 0.0 109.59 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.055 -1.028 . . . . 0.0 109.326 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.485 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.256 0.551 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -75.81 158.45 32.16 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.216 -0.927 . . . . 0.0 110.019 -179.724 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.32 158.42 19.95 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 3' ' ' GLY . 0.0 OUTLIER -45.3 156.53 0.11 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.059 -1.26 . . . . 0.0 110.136 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 55.62 11.0 3.57 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -80.92 22.49 0.61 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.808 -1.407 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 56.41 151.33 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.07 -1.019 . . . . 0.0 110.713 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.9 p 177.73 -151.06 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 109.881 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 68.2 m -115.27 -123.48 0.29 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.375 -0.828 . . . . 0.0 109.509 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 21.7 mmm180 -118.17 -41.24 2.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.777 -1.202 . . . . 0.0 109.798 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.58 70.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.194 -0.941 . . . . 0.0 109.623 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.2 mtm -102.56 -7.63 21.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 62.68 52.6 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.61 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -126.81 -9.07 6.09 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.0 109.811 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 83.4 m -72.23 119.65 16.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 4.2 t -68.82 -13.42 62.39 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.577 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 23.2 p -122.44 2.93 9.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.881 -1.137 . . . . 0.0 111.507 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.495 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 169.01 -124.0 1.13 Allowed Glycine 0 N--CA 1.494 2.52 0 C-N-CA 118.927 -1.606 . . . . 0.0 110.491 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -132.83 -161.82 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.434 -1.039 . . . . 0.0 109.714 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.1 m -86.07 128.39 34.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.413 -0.804 . . . . 0.0 110.262 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.0 141.75 50.71 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.326 -0.859 . . . . 0.0 108.819 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.0 t 47.72 23.55 0.44 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.307 -0.87 . . . . 0.0 109.496 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.52 -33.23 5.44 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.6 mttp -96.15 171.66 8.46 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.109 -1.23 . . . . 0.0 109.806 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 0.0 109.558 -179.991 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.542 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.326 0.584 . . . . 0.0 109.597 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -82.33 157.78 23.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 109.893 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.51 162.0 30.24 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.522 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.57 156.26 3.57 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.028 -1.278 . . . . 0.0 109.819 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 64.79 6.22 22.66 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.0 26.68 0.33 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.912 -1.346 . . . . 0.0 110.7 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.43 155.55 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.283 0 O-C-N 120.979 -1.076 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 16.5 p -179.2 -158.67 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.38 -0.825 . . . . 0.0 109.745 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 3.5 t -106.96 -102.37 0.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.648 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.461 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.0 ttt180 -140.23 -44.36 0.42 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.075 -1.016 . . . . 0.0 109.857 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.22 39.01 1.92 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.846 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.503 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 7.9 mmt -78.78 -22.48 46.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.074 -1.016 . . . . 0.0 109.156 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 38.9 m-85 60.85 73.14 0.49 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -0.871 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' HB2' ' A' ' 12' ' ' MET . 0.0 OUTLIER -134.94 9.58 3.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.322 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 18.5 m -86.13 125.41 33.47 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.178 -0.951 . . . . 0.0 109.794 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.542 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -66.7 -23.89 66.18 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.717 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -153.18 72.04 0.93 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.16 -0.963 . . . . 0.0 109.667 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 150.99 -167.96 30.63 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.3 t -138.55 161.32 37.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -1.117 . . . . 0.0 109.299 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.3 m -52.08 127.27 21.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.324 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER -139.12 121.75 16.32 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.164 -0.96 . . . . 0.0 109.816 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.55 10.29 4.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 109.908 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.78 -2.44 33.97 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -121.99 174.48 6.88 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.045 -1.268 . . . . 0.0 109.64 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.62 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.525 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.6 mmtt -107.48 -166.75 1.18 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.247 -0.908 . . . . 0.0 109.946 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.46 160.54 25.15 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.4 pttp -53.55 152.0 5.37 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.959 -1.318 . . . . 0.0 109.451 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.03 -31.5 7.26 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 107.61 -2.196 . . . . 0.0 107.61 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.33 80.21 3.84 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.9 pttt -28.44 149.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.443 0.639 . . . . 0.0 110.739 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -150.98 -162.32 1.53 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.099 -1.001 . . . . 0.0 109.904 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.51 ' HB2' ' CG ' ' A' ' 12' ' ' MET . 73.2 m -94.07 -101.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.209 -0.932 . . . . 0.0 109.703 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -167.48 115.65 0.79 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.509 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 76.02 16.06 2.36 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.322 -0.861 . . . . 0.0 109.612 179.813 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.51 ' CG ' ' HB2' ' A' ' 9' ' ' SER . 36.4 mmt -74.17 -9.31 58.49 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.123 -0.986 . . . . 0.0 109.265 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 12' ' ' MET . 19.2 m-85 42.52 57.05 3.58 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -0.852 . . . . 0.0 109.549 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -116.55 -22.08 8.87 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.28 -0.887 . . . . 0.0 109.24 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.8 m -61.76 124.25 20.21 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.192 0.996 . . . . 0.0 109.837 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.525 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -66.9 -36.94 83.41 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.72 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 t -128.9 72.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.337 -0.852 . . . . 0.0 109.408 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.63 -158.3 26.54 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 p -148.63 168.16 23.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.101 . . . . 0.0 109.376 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 8.6 m -57.65 92.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.345 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 24' ' ' LYS . 8.8 ttm180 -103.7 135.23 45.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.325 -0.859 . . . . 0.0 109.403 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 t 58.6 22.13 9.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.247 -0.908 . . . . 0.0 109.379 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.13 -14.77 61.3 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 32.3 mttm -107.15 172.48 6.8 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.12 -1.223 . . . . 0.0 109.518 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.46 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.096 -1.003 . . . . 0.0 109.217 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.576 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.279 0.561 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 15.4 mmtm -122.52 -167.65 1.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 109.838 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.431 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -143.72 161.88 27.74 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -41.1 148.52 0.11 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.365 -1.08 . . . . 0.0 110.107 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.97 -34.18 5.09 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 107.963 -2.055 . . . . 0.0 107.963 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.62 80.57 4.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.591 -0.946 . . . . 0.0 108.785 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -33.09 155.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.248 0.547 . . . . 0.0 110.39 -179.567 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -142.48 -145.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.032 -1.043 . . . . 0.0 109.904 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.541 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -111.95 7.16 19.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.816 -1.178 . . . . 0.0 110.351 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.547 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 0.0 OUTLIER 82.95 -13.62 0.8 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.638 -0.664 . . . . 0.0 109.772 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.06 22.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.044 -1.035 . . . . 0.0 109.503 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -83.25 -21.13 33.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.183 -0.948 . . . . 0.0 109.049 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.7 m-85 61.95 66.95 0.78 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.888 . . . . 0.0 109.837 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 15.9 p-10 -118.3 -20.25 8.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.189 -0.945 . . . . 0.0 109.257 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -60.68 127.38 31.39 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.919 0.866 . . . . 0.0 109.22 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.576 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -61.87 -41.1 97.45 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -131.6 120.75 23.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.409 -0.807 . . . . 0.0 108.977 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.18 -152.51 17.05 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.299 -1.52 . . . . 0.0 109.299 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 m -150.92 161.04 43.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.086 -1.244 . . . . 0.0 109.711 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -48.51 117.56 2.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 0.0 109.262 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.8 ttm180 -113.65 136.32 52.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.043 -1.036 . . . . 0.0 109.333 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 49.26 27.32 1.82 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 109.437 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.36 -22.22 21.06 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 7.1 mtmt -100.35 168.42 9.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.172 -1.193 . . . . 0.0 109.651 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 O-C-N 120.936 -1.102 . . . . 0.0 108.829 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.395 0.617 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.528 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -71.11 159.67 34.28 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.318 -0.864 . . . . 0.0 109.603 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.66 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -105.15 168.96 16.02 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -55.73 163.12 1.47 Allowed 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.086 -1.244 . . . . 0.0 109.655 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 43.84 25.1 0.56 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.59 21.86 0.49 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -1.126 . . . . 0.0 111.119 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.494 ' C ' ' O ' ' A' ' 6' ' ' ALA . 12.1 pttm 34.72 43.1 0.09 Allowed 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.992 0.901 . . . . 0.0 109.624 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.64 ' N ' ' O ' ' A' ' 23' ' ' GLY . 20.7 p -68.52 -148.95 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 CA-C-O 121.44 0.638 . . . . 0.0 109.923 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 0.6 OUTLIER -106.53 -140.45 0.37 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.575 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.483 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ttp180 -132.98 116.48 16.47 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.111 -0.993 . . . . 0.0 108.889 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER 63.42 45.57 4.78 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.723 -0.61 . . . . 0.0 109.854 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.483 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 1.4 mmm -100.06 -5.37 28.11 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.379 -0.826 . . . . 0.0 109.235 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 55.07 53.4 10.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.358 -0.839 . . . . 0.0 109.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.497 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 56.2 m-20 -124.12 -28.89 3.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.268 -0.895 . . . . 0.0 109.715 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 89.2 m -44.65 125.3 4.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 109.367 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -64.38 -28.69 69.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.41 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.455 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.3 p -153.66 31.8 0.46 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.024 -1.047 . . . . 0.0 109.73 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -154.9 -159.62 9.39 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' N ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -133.97 122.91 23.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -1.074 . . . . 0.0 109.219 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' SER . 1.6 m -43.01 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.53 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -113.32 137.82 50.94 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.182 -0.948 . . . . 0.0 109.268 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.47 24.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.042 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.64 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 87.0 -21.47 19.75 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 23.7 mttt -93.09 134.07 35.62 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.839 -1.389 . . . . 0.0 109.117 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.297 -1.71 0 O-C-N 121.568 -0.708 . . . . 0.0 109.526 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.556 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.318 0.58 . . . . 0.0 109.489 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -88.79 166.25 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.266 -0.896 . . . . 0.0 109.701 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -118.67 153.02 17.17 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -42.43 147.83 0.25 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -1.104 . . . . 0.0 110.02 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.97 -29.34 8.79 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.86 75.17 0.46 Allowed 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.541 -0.976 . . . . 0.0 108.529 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.26 149.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.614 0.721 . . . . 0.0 110.586 -179.611 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -152.11 -156.96 0.75 Allowed 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.213 -0.93 . . . . 0.0 109.799 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.481 ' HB3' ' HG2' ' A' ' 12' ' ' MET . 10.7 t -93.42 -110.86 0.11 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.289 -0.882 . . . . 0.0 109.52 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' OG ' ' A' ' 9' ' ' SER . 52.4 ttt180 -135.35 -45.7 0.69 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.775 -1.203 . . . . 0.0 110.024 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.16 45.57 2.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.006 -1.059 . . . . 0.0 109.951 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' HB3' ' A' ' 9' ' ' SER . 14.5 mmt -80.36 -36.98 33.3 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.069 -1.02 . . . . 0.0 109.058 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.416 ' HB2' ' O ' ' A' ' 12' ' ' MET . 5.0 m-30 60.16 35.24 21.13 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.43 -0.794 . . . . 0.0 109.989 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -94.96 -12.15 27.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.123 -0.985 . . . . 0.0 108.962 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.2 m -57.61 133.64 55.47 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.105 0.955 . . . . 0.0 109.607 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.556 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.0 t -66.05 -30.38 70.9 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.257 -179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 17' ' ' THR . 1.7 t -142.32 81.0 1.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.952 -1.092 . . . . 0.0 109.952 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.48 -160.0 25.0 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.24 164.58 29.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.409 -1.054 . . . . 0.0 109.388 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 m -50.5 99.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -0.937 . . . . 0.0 109.521 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -112.98 145.93 39.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.139 -0.976 . . . . 0.0 109.746 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.7 t 55.31 26.33 8.49 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.443 -0.786 . . . . 0.0 109.519 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.67 -6.97 59.88 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -121.03 179.36 4.4 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.485 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.299 -1.593 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.954 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 4.1 p . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.291 0.567 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.6 mmtp -106.94 -176.77 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.21 -0.931 . . . . 0.0 110.107 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.54 163.91 12.66 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -50.25 156.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.948 -1.324 . . . . 0.0 109.19 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.66 -32.08 6.33 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -74.04 77.23 1.71 Allowed 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 178.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -30.71 150.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 121.338 0.589 . . . . 0.0 110.338 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -146.79 -166.09 2.41 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.986 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -94.31 -102.63 0.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.327 -0.858 . . . . 0.0 109.611 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.1 ttm180 -148.31 112.92 5.35 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.158 -0.964 . . . . 0.0 109.174 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.5 mt 64.01 28.25 14.34 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.445 -0.784 . . . . 0.0 109.453 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 2.5 mmt -58.74 -21.71 56.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.315 -0.866 . . . . 0.0 109.447 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' MET . 40.5 m-85 59.27 33.96 22.81 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.739 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -110.41 -30.48 7.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.253 -0.905 . . . . 0.0 109.241 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -54.37 124.43 15.95 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 122.214 1.007 . . . . 0.0 109.042 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.7 t -66.8 -25.09 66.29 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.759 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 18' ' ' GLY . 54.5 p -90.73 -128.84 0.09 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.237 -0.915 . . . . 0.0 109.089 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.9 -119.33 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.0 p -146.52 175.45 10.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.126 -1.22 . . . . 0.0 109.456 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.3 m -45.39 103.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.236 -0.915 . . . . 0.0 109.462 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.11 133.33 50.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 109.334 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.27 22.86 2.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.136 -0.978 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.43 -19.52 46.83 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.1 mtpt -101.22 159.46 15.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -1.162 . . . . 0.0 109.384 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.077 -1.014 . . . . 0.0 109.113 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.574 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.222 0.534 . . . . 0.0 109.759 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 27.0 mmtm -81.52 -171.73 3.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.301 -0.875 . . . . 0.0 109.618 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.709 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -122.79 161.92 16.81 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -58.75 162.67 3.83 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.295 -1.121 . . . . 0.0 109.777 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 47.79 24.14 2.8 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.709 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.62 21.87 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.321 -1.105 . . . . 0.0 111.479 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.515 ' C ' ' O ' ' A' ' 6' ' ' ALA . 19.9 ptmt 30.79 44.65 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 121.887 0.851 . . . . 0.0 110.11 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.61 ' N ' ' O ' ' A' ' 23' ' ' GLY . 29.7 p -70.63 -153.64 0.02 OUTLIER 'General case' 0 C--N 1.29 -2.012 0 O-C-N 121.815 -0.553 . . . . 0.0 109.869 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.451 ' O ' ' HA2' ' A' ' 23' ' ' GLY . 1.4 t -103.26 -140.93 0.36 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 109.868 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.544 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.6 OUTLIER -128.43 108.43 10.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.067 -1.021 . . . . 0.0 109.148 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.544 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 80.2 53.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.555 -0.716 . . . . 0.0 109.52 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.8 mmm -103.27 -16.44 15.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.944 . . . . 0.0 109.289 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 57.09 50.7 11.51 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' C ' ' A' ' 15' ' ' CYS . 1.0 OUTLIER -124.13 -27.24 3.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.717 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.48 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 64.8 m -45.47 123.08 3.92 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 122.122 0.963 . . . . 0.0 109.763 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.574 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.7 t -67.28 -9.95 45.96 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.077 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.8 p -130.2 -5.13 4.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.716 -1.24 . . . . 0.0 111.006 -178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.48 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . -170.24 -127.84 0.97 Allowed Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.377 -1.392 . . . . 0.0 110.023 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.422 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 33.0 t -140.58 162.68 34.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.274 -1.133 . . . . 0.0 109.519 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.3 m -51.11 126.56 16.82 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.91 . . . . 0.0 109.636 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.13 123.35 40.11 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.165 -0.959 . . . . 0.0 109.061 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.75 27.45 4.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 108.765 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.61 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 91.06 -32.7 5.02 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 1.4 mttm -92.73 135.85 33.74 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.366 -1.079 . . . . 0.0 109.277 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.618 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.482 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.557 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.479 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 2.5 mptt -81.84 161.7 23.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.324 -0.86 . . . . 0.0 110.115 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -109.19 161.68 13.03 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 108.812 -1.715 . . . . 0.0 108.812 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -41.37 150.47 0.09 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.289 -1.124 . . . . 0.0 109.926 -179.615 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 96.22 -31.57 7.26 Favored Glycine 0 N--CA 1.487 2.069 0 N-CA-C 107.881 -2.087 . . . . 0.0 107.881 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.11 75.89 0.34 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -28.93 150.09 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.399 0.619 . . . . 0.0 110.475 -179.418 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.9 p -157.16 -161.67 1.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.136 -0.978 . . . . 0.0 109.735 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 86.9 p -98.84 -143.72 0.32 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.296 -0.877 . . . . 0.0 109.425 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -30.22 18.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.0 109.445 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.3 mt -153.84 44.07 0.58 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.177 -0.952 . . . . 0.0 109.956 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -53.31 -23.68 9.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.065 -1.022 . . . . 0.0 109.162 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 12' ' ' MET . 10.7 m-85 63.67 36.1 11.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.622 179.254 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.03 -25.47 5.77 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.087 -1.008 . . . . 0.0 109.304 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.8 m -52.93 126.21 19.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.987 . . . . 0.0 109.157 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.557 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.87 -28.04 68.01 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.349 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.98 135.65 47.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.066 -1.021 . . . . 0.0 109.719 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.26 -176.29 3.89 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.26 -171.83 1.94 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.28 -1.129 . . . . 0.0 109.47 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 9' ' ' SER . 9.0 m -61.37 103.34 0.3 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.303 -0.873 . . . . 0.0 109.446 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . 28.6 tpt180 -97.81 135.72 39.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 t 51.5 32.52 8.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.278 -0.889 . . . . 0.0 109.718 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.27 -9.7 46.59 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -110.94 172.02 7.12 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.015 -1.286 . . . . 0.0 109.552 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m . . . . . 0 C--N 1.3 -1.562 0 C-N-CA 119.46 -0.896 . . . . 0.0 108.839 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 7.5 p . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 121.303 0.573 . . . . 0.0 109.535 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 16.5 mmtt -99.04 168.96 9.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 109.91 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.45 169.43 20.47 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.02 156.97 13.68 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.177 -1.19 . . . . 0.0 110.102 -179.548 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 70.9 -0.87 26.94 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.06 22.03 0.54 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.971 -1.311 . . . . 0.0 110.963 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.88 154.17 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.941 -1.099 . . . . 0.0 110.46 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 30.9 p 175.14 173.95 0.23 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.482 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -93.33 -163.36 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.1 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' CG ' HH11 ' A' ' 10' ' ' ARG . 0.0 OUTLIER -60.61 -61.44 2.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.031 -1.043 . . . . 0.0 109.519 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' CZ ' ' A' ' 13' ' ' TYR . 2.6 mp -138.04 72.63 1.42 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.274 -0.891 . . . . 0.0 109.614 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.493 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -86.57 -14.9 41.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.105 -0.997 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.493 ' CD2' ' O ' ' A' ' 12' ' ' MET . 3.9 m-85 69.29 54.73 0.41 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -130.23 -11.19 4.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.136 -0.977 . . . . 0.0 110.134 -179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.1 m -73.15 124.62 25.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.118 -0.989 . . . . 0.0 109.882 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -67.09 -27.4 67.32 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 121.369 0.604 . . . . 0.0 109.42 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' THR . 4.5 t -150.91 126.85 10.39 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.261 -0.899 . . . . 0.0 109.281 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.26 -166.93 28.61 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.07 -167.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -1.147 . . . . 0.0 109.673 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.482 ' SG ' ' O ' ' A' ' 9' ' ' SER . 6.9 m -85.43 117.38 24.31 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.361 -0.837 . . . . 0.0 109.728 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 24' ' ' LYS . 4.2 ttt180 -122.67 131.01 53.61 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.167 -0.958 . . . . 0.0 109.268 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 57.41 28.18 15.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.294 -0.879 . . . . 0.0 109.208 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.93 7.63 88.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 10.5 mtpt -120.26 162.34 19.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.191 -1.182 . . . . 0.0 110.0 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.462 -0.774 . . . . 0.0 109.301 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -111.15 168.62 9.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.86 . . . . 0.0 109.976 -179.629 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.2 165.17 25.06 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.424 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.8 153.55 24.17 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.094 -1.239 . . . . 0.0 110.109 -179.706 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.71 2.73 12.47 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.12 28.64 0.29 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.825 -1.397 . . . . 0.0 110.902 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.56 157.04 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.893 -1.13 . . . . 0.0 110.358 -179.958 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.523 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.2 p 179.23 -174.06 0.2 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.432 -0.793 . . . . 0.0 109.961 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.2 t -94.48 -118.52 0.1 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.248 -0.907 . . . . 0.0 109.404 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -119.86 -76.65 0.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.915 -1.116 . . . . 0.0 109.679 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.573 HD23 ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -111.76 28.51 8.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.054 -1.029 . . . . 0.0 109.756 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mmt -59.09 -22.65 61.15 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.295 -0.878 . . . . 0.0 109.204 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.0 m-85 62.76 56.61 1.9 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.405 -0.81 . . . . 0.0 109.845 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.428 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 75.2 m-20 -114.38 -37.94 4.21 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 28.4 m -44.1 125.03 4.2 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 109.544 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.2 t -66.81 -10.09 44.1 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.936 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 18' ' ' GLY . 17.6 p -146.21 -106.65 0.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.891 . . . . 0.0 109.556 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -43.82 167.16 0.02 OUTLIER Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 p -94.94 -168.85 1.88 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.204 -1.174 . . . . 0.0 109.614 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.0 m -81.92 117.52 22.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.315 -0.865 . . . . 0.0 109.792 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.27 113.44 26.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.129 -0.982 . . . . 0.0 109.324 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 16.35 2.01 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.686 -0.634 . . . . 0.0 109.804 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 112.18 -19.11 22.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.1 mtpp -93.48 151.92 19.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.099 -1.236 . . . . 0.0 109.637 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 109.55 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.57 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.5 p . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.354 0.597 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HA ' ' CE ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -90.48 -169.4 2.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.534 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -121.18 153.2 16.67 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 6' ' ' ALA . 1.2 ttmt -48.84 152.77 0.95 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.935 -1.332 . . . . 0.0 109.958 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 45.95 18.03 0.23 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -81.36 26.17 0.47 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.318 . . . . 0.0 110.715 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.77 157.9 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.042 -1.036 . . . . 0.0 110.284 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 15.5 p -179.48 -157.64 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.352 -0.842 . . . . 0.0 110.115 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.85 -89.27 0.58 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.402 -0.811 . . . . 0.0 109.739 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -141.41 -118.72 0.11 Allowed 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.421 -0.799 . . . . 0.0 109.861 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.8 mm? -79.01 52.9 1.33 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.737 -1.227 . . . . 0.0 110.02 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.7 mmm -75.78 -13.14 60.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.134 -0.979 . . . . 0.0 109.003 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 53.32 47.02 25.17 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.393 -0.817 . . . . 0.0 109.968 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' CYS . 12.7 t0 -110.87 -30.04 7.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 109.235 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 19' ' ' SER . 74.4 m -43.58 124.19 3.44 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.093 0.949 . . . . 0.0 109.404 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.57 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.77 -22.99 66.02 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 17' ' ' THR . 10.4 t -153.96 54.5 0.71 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.967 . . . . 0.0 109.746 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 167.39 -147.51 11.86 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 28.3 t -146.26 -162.8 1.6 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.337 -1.096 . . . . 0.0 109.526 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.0 m -94.43 105.3 17.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.744 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.7 OUTLIER -119.38 131.89 55.75 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.203 -0.935 . . . . 0.0 109.061 179.665 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.407 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 22.7 t 62.5 14.82 7.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.323 -0.861 . . . . 0.0 109.322 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.441 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.16 -23.87 34.29 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.2 mtmm -100.55 170.16 8.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.21 -1.171 . . . . 0.0 109.934 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.549 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.562 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.388 0.613 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 2.7 mptp? -84.84 -174.97 5.56 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.0 109.843 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.21 169.56 14.91 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.495 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.7 mtpt -57.21 150.75 17.03 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.103 -1.233 . . . . 0.0 109.959 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.36 -4.87 38.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.507 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.9 25.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.245 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.62 157.59 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 O-C-N 120.941 -1.099 . . . . 0.0 110.884 179.835 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.0 p -179.9 -157.47 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.438 -0.789 . . . . 0.0 109.789 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.511 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 0.3 OUTLIER -116.78 -82.79 0.63 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.924 . . . . 0.0 109.548 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.527 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -156.96 -66.65 0.1 Allowed 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.428 -0.795 . . . . 0.0 109.902 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.428 HD12 ' HB3' ' A' ' 10' ' ' ARG . 2.3 mp -107.51 24.58 12.67 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.094 -1.004 . . . . 0.0 109.955 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.511 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 0.0 OUTLIER -57.25 -26.64 61.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.171 -0.956 . . . . 0.0 108.9 179.536 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 49.32 33.44 5.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.495 -0.753 . . . . 0.0 110.073 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.52 -24.56 16.01 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.122 -0.986 . . . . 0.0 108.924 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 m -51.84 125.07 14.1 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 122.19 0.995 . . . . 0.0 109.568 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.562 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.4 t -67.0 -12.56 60.21 Favored 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.6 p -106.07 -122.23 0.23 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.219 -0.926 . . . . 0.0 109.745 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.21 -129.58 0.08 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -120.85 -171.68 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.276 -1.132 . . . . 0.0 109.7 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.8 m -63.22 155.24 28.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.684 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.413 ' N ' ' O ' ' A' ' 24' ' ' LYS . 60.3 ttt180 -146.08 124.46 12.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.333 -0.855 . . . . 0.0 109.334 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.1 m 52.1 24.61 2.79 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.846 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.452 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.13 -24.24 32.69 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.3 mttt -93.95 177.39 6.0 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.048 -1.266 . . . . 0.0 109.544 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.579 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.294 0.568 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -113.68 168.53 9.69 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.274 -0.891 . . . . 0.0 109.552 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.41 154.35 17.14 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -55.33 155.42 5.13 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.967 -1.313 . . . . 0.0 109.748 -179.765 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.5 -13.32 11.86 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.524 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.16 37.74 0.33 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.82 -1.4 . . . . 0.0 111.097 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 mttp 50.57 167.94 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.5 p 179.17 -175.54 0.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.076 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.484 ' O ' ' HD3' ' A' ' 10' ' ' ARG . 2.9 m -105.26 -103.74 0.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.355 -0.84 . . . . 0.0 109.514 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 9' ' ' SER . 3.2 mmt180 -128.26 -106.99 0.3 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.038 -1.039 . . . . 0.0 109.592 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.55 70.01 3.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.736 -1.228 . . . . 0.0 109.606 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 19.2 mmt -97.66 -31.71 12.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -0.906 . . . . 0.0 109.547 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.513 ' CB ' ' O ' ' A' ' 12' ' ' MET . 3.1 m-85 77.56 40.91 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.5 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.468 ' OD2' ' HB2' ' A' ' 12' ' ' MET . 2.9 m-20 -96.48 -25.47 15.65 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.133 -0.979 . . . . 0.0 109.236 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 33.2 m -55.54 127.03 27.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.218 -0.926 . . . . 0.0 109.776 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -65.76 -30.58 71.26 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.542 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.412 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.2 p -150.55 37.49 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.003 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -164.94 -155.52 8.52 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 p -147.93 167.91 23.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.35 -1.088 . . . . 0.0 109.047 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 1.6 m -56.03 125.06 19.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.105 -0.997 . . . . 0.0 109.215 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -121.2 100.22 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.173 -0.954 . . . . 0.0 109.689 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.98 2.21 3.48 Favored 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.84 -0.538 . . . . 0.0 110.316 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.458 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 137.74 -30.24 2.59 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 119.587 -1.292 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -102.73 177.31 4.89 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.995 -1.297 . . . . 0.0 109.998 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.493 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.421 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.396 0.617 . . . . 0.0 109.609 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -104.61 165.09 11.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.901 . . . . 0.0 109.759 -179.775 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.43 165.0 16.66 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 8.3 mtpp -59.96 150.08 30.01 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.123 -1.222 . . . . 0.0 110.389 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 57.14 9.05 3.76 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.77 27.68 0.37 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.727 -1.454 . . . . 0.0 110.647 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.72 154.46 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 O-C-N 121.039 -1.038 . . . . 0.0 110.894 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 14.9 p -178.71 -158.19 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.8 p -98.0 -131.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.366 -0.834 . . . . 0.0 109.496 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 11' ' ' LEU . 65.9 mtm180 -134.63 -0.5 2.88 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.786 -1.196 . . . . 0.0 110.382 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -174.44 35.12 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.785 -1.197 . . . . 0.0 110.566 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.445 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -91.22 -19.57 22.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.17 -0.956 . . . . 0.0 108.793 179.25 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.1 m-85 61.61 57.92 2.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.468 -0.77 . . . . 0.0 110.253 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.445 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 0.8 OUTLIER -106.82 -11.05 15.86 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.224 -0.922 . . . . 0.0 109.014 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 72.8 m -57.82 125.76 24.45 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 122.05 0.929 . . . . 0.0 110.026 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.9 t -57.96 -33.01 68.39 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.967 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -143.27 -22.03 0.62 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.06 -1.025 . . . . 0.0 111.276 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -101.69 -148.33 21.2 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.432 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 66.1 p -140.25 -174.17 3.87 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.426 -1.044 . . . . 0.0 108.994 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 m -91.78 96.18 10.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.02 -1.05 . . . . 0.0 109.395 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 143.78 50.67 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 65.2 28.61 12.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.284 -0.885 . . . . 0.0 109.578 -180.0 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.99 11.65 67.04 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.2 mtmm -140.83 173.3 11.62 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.295 -1.769 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.101 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.54 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.269 0.556 . . . . 0.0 109.515 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 11.7 mmtt -95.11 -172.4 2.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.387 -0.821 . . . . 0.0 109.962 -179.51 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.439 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -139.73 157.54 25.28 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -43.65 152.05 0.17 Allowed 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.294 -1.121 . . . . 0.0 109.699 -179.856 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.18 -30.27 6.45 Favored Glycine 0 N--CA 1.485 1.955 0 N-CA-C 108.245 -1.942 . . . . 0.0 108.245 -179.055 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.07 76.19 3.63 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.459 -1.024 . . . . 0.0 108.533 179.248 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.47 153.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.177 0.513 . . . . 0.0 110.222 -179.652 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 24.6 p -144.28 -160.48 1.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.071 -1.018 . . . . 0.0 109.518 -179.555 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.02 -83.7 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.127 -0.983 . . . . 0.0 109.459 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -175.18 105.82 0.09 Allowed 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.469 -0.77 . . . . 0.0 109.64 -179.975 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 70.06 44.33 0.8 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.328 -0.858 . . . . 0.0 109.899 179.807 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.464 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 13.5 mmm -90.52 -15.61 30.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 109.0 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 55.62 59.29 3.94 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.726 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 5.1 m-20 -124.21 -30.18 3.48 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.194 -0.941 . . . . 0.0 109.523 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 12.2 m -49.56 125.0 10.46 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 122.066 0.936 . . . . 0.0 109.348 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.54 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.5 t -66.77 -14.65 62.85 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.125 -179.558 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 t -119.71 31.73 6.41 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.085 -1.009 . . . . 0.0 109.862 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 141.98 -150.89 22.42 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 179.771 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 20' ' ' CYS . 7.5 p -124.16 175.88 6.74 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.364 -1.08 . . . . 0.0 109.288 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 19' ' ' SER . 16.8 m -44.58 147.11 0.63 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.205 -0.934 . . . . 0.0 109.62 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.1 ttt180 -123.6 100.8 6.98 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -0.822 . . . . 0.0 108.841 179.377 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 p 59.89 12.89 3.29 Favored 'General case' 0 C--N 1.292 -1.903 0 O-C-N 121.801 -0.562 . . . . 0.0 110.045 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.46 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 127.92 -37.71 2.25 Favored Glycine 0 N--CA 1.493 2.457 0 C-N-CA 119.803 -1.189 . . . . 0.0 110.241 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -103.07 162.59 12.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.1 -1.235 . . . . 0.0 109.86 -179.509 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 O-C-N 120.823 -1.173 . . . . 0.0 109.012 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.55 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -116.36 -167.49 1.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.195 -0.94 . . . . 0.0 110.332 -179.015 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.02 161.46 25.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.479 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -59.53 152.78 21.12 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.421 . . . . 0.0 109.37 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.58 -34.73 4.68 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 107.311 -2.316 . . . . 0.0 107.311 -178.665 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.39 83.33 3.83 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.67 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.57 152.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.361 0.6 . . . . 0.0 110.527 -179.549 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -156.95 -156.18 0.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.02 -1.05 . . . . 0.0 109.848 -179.303 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -93.73 -137.29 0.2 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 -179.754 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 2.6 mtp180 -134.77 112.79 11.02 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 120.923 -1.11 . . . . 0.0 109.191 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.6 mp 63.64 65.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.618 -0.676 . . . . 0.0 109.564 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.466 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -116.68 -16.62 10.68 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.417 -0.802 . . . . 0.0 109.23 179.828 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 18.0 m-85 66.26 43.84 2.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -0.856 . . . . 0.0 109.889 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 11.8 m-20 -110.83 -34.04 6.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.179 -0.951 . . . . 0.0 109.465 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 27.2 m -52.45 124.22 12.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.142 -0.974 . . . . 0.0 109.207 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.55 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.34 -24.28 66.5 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.656 -179.548 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.99 83.75 2.0 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.305 -0.872 . . . . 0.0 109.491 179.903 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.88 -154.76 16.71 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 t -147.44 158.0 43.8 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.245 -1.15 . . . . 0.0 109.488 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 19.7 m -45.75 103.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.837 . . . . 0.0 109.382 -179.971 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . 38.9 ttp180 -111.9 136.04 51.72 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.093 -1.004 . . . . 0.0 109.453 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.21 14.3 4.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.368 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.31 -23.49 35.1 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -104.65 176.38 5.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.172 -1.193 . . . . 0.0 109.798 -179.914 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.479 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.53 0 C-N-CA 119.326 -0.95 . . . . 0.0 109.004 179.792 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -106.07 173.85 6.14 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.218 -0.926 . . . . 0.0 109.655 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -122.81 155.95 17.21 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 2.0 ttmt -41.88 150.82 0.11 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 121.283 -1.128 . . . . 0.0 109.815 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.77 -31.47 6.17 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 108.064 -2.015 . . . . 0.0 108.064 -179.105 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -71.98 75.83 0.92 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.554 -0.968 . . . . 0.0 108.563 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.38 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.223 0.535 . . . . 0.0 110.346 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -148.63 -168.27 3.05 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.017 -1.052 . . . . 0.0 110.09 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.62 -88.97 0.22 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.773 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.682 ' C ' HD22 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -148.52 -74.74 0.18 Allowed 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.505 -0.747 . . . . 0.0 109.528 -179.585 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 10' ' ' ARG . 3.6 mm? -108.87 33.74 4.07 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.718 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.417 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.23 -20.6 66.17 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.148 -0.97 . . . . 0.0 109.336 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 57.2 65.92 1.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.854 . . . . 0.0 109.703 179.775 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.7 OUTLIER -127.77 -32.35 2.36 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.213 -0.929 . . . . 0.0 109.612 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -56.67 126.9 28.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.931 . . . . 0.0 109.259 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.0 t -66.37 -33.92 76.8 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.235 0.54 . . . . 0.0 109.583 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.67 130.82 56.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 109.354 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 58.72 -166.41 7.44 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.431 -1.467 . . . . 0.0 109.431 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' C ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.41 179.65 4.24 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.226 -1.161 . . . . 0.0 109.482 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.408 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.3 m -43.76 130.2 5.55 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.352 -0.843 . . . . 0.0 109.258 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -127.91 123.09 34.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.29 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.71 24.4 14.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.242 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.65 -19.65 39.62 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.1 mttm -109.26 171.9 7.16 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.108 -1.231 . . . . 0.0 109.346 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m . . . . . 0 C--N 1.299 -1.593 0 C-N-CA 119.309 -0.957 . . . . 0.0 109.031 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.517 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.387 0.613 . . . . 0.0 109.544 . . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.8 mmtt -88.74 -178.8 5.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 109.877 -179.523 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -135.3 169.43 23.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp -47.3 148.92 1.14 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 120.924 -1.339 . . . . 0.0 109.615 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.21 -33.18 5.23 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 107.831 -2.107 . . . . 0.0 107.831 -178.946 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -70.38 75.25 0.54 Allowed 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 4.0 ptmt -31.76 151.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.451 0.643 . . . . 0.0 110.249 -179.079 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.06 -164.24 1.65 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.17 -0.956 . . . . 0.0 109.542 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -94.06 -164.76 1.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 109.233 179.99 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -75.72 -25.5 56.67 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.085 -1.01 . . . . 0.0 109.177 179.727 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.529 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -156.63 91.05 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 0.0 109.393 179.75 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.534 ' C ' ' CD2' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -114.98 -15.02 11.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.245 -0.909 . . . . 0.0 109.295 -179.866 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CD2' ' C ' ' A' ' 12' ' ' MET . 1.5 m-85 55.79 30.66 16.14 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.875 . . . . 0.0 109.591 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' CG ' ' HB3' ' A' ' 12' ' ' MET . 3.3 p30 -101.86 -31.15 10.86 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.166 -0.959 . . . . 0.0 109.345 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -54.67 124.5 16.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.108 -0.995 . . . . 0.0 108.918 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.517 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -66.29 -30.87 71.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 121.354 0.597 . . . . 0.0 109.484 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -130.96 128.06 39.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.306 -0.872 . . . . 0.0 109.393 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.45 -151.75 34.91 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.38 -157.67 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -1.155 . . . . 0.0 109.621 -179.963 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 9' ' ' SER . 21.8 m -86.09 96.7 9.96 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 109.529 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 24.8 ttp180 -95.04 139.35 31.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.046 -1.034 . . . . 0.0 109.786 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.9 m 53.63 20.63 2.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -0.01 81.92 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.9 mtmm -118.52 164.91 14.59 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.139 -1.212 . . . . 0.0 109.882 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 119.299 -0.96 . . . . 0.0 108.782 179.597 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 1' ' ' CYS . . . . . 0.591 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.42 0.629 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.557 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -82.52 162.68 21.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.334 -0.854 . . . . 0.0 109.668 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.66 160.08 18.19 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.964 -1.655 . . . . 0.0 108.964 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -50.98 146.78 5.71 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.161 -1.199 . . . . 0.0 110.715 -179.401 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 71.51 -10.92 3.43 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 179.136 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.67 36.69 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.576 -1.543 . . . . 0.0 111.392 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 51.67 161.19 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.122 -0.987 . . . . 0.0 110.988 179.731 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' GLY . 24.4 p 179.05 -167.0 0.07 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.237 -0.914 . . . . 0.0 109.665 179.926 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.55 ' CB ' ' HB2' ' A' ' 12' ' ' MET . 0.3 OUTLIER -93.73 -161.8 0.88 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.426 -0.797 . . . . 0.0 109.234 -179.95 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.481 ' C ' HD12 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -91.74 -32.58 15.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.031 -1.043 . . . . 0.0 108.9 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' C ' ' A' ' 10' ' ' ARG . 1.2 mp -153.18 22.37 0.56 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.655 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' MET . . . . . 0.55 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 57.2 tpp -62.56 -17.74 60.61 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.3 m-85 63.27 49.03 3.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.471 -0.768 . . . . 0.0 110.344 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.75 -21.31 15.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 0.0 108.548 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.2 m -56.23 125.59 22.45 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 122.038 0.923 . . . . 0.0 109.264 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.591 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.1 -34.89 79.1 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.595 -179.759 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.77 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -154.56 89.89 1.29 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.35 -0.844 . . . . 0.0 109.346 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 151.85 -149.77 21.54 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 m -139.31 178.33 7.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.165 -1.197 . . . . 0.0 109.458 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.8 m -95.68 106.92 19.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.885 . . . . 0.0 109.729 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -118.06 135.84 53.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.484 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.26 28.81 4.45 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.323 -0.86 . . . . 0.0 109.681 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 80.02 -5.98 60.84 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 17.7 mttm -100.55 146.15 27.46 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.329 -1.1 . . . . 0.0 109.156 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.443 0 O-C-N 121.163 -0.961 . . . . 0.0 109.146 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.343 0.592 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.541 ' N ' ' CD ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -96.52 162.81 13.31 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.22 -0.925 . . . . 0.0 110.032 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -107.12 161.66 13.69 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HE2' ' NH1' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -43.56 159.81 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.178 -1.189 . . . . 0.0 109.819 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.03 12.13 10.58 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.88 16.52 1.15 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.074 -1.251 . . . . 0.0 110.625 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER 56.33 154.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.207 -0.933 . . . . 0.0 110.479 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.3 p 178.38 -147.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.577 -0.702 . . . . 0.0 109.504 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.435 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.9 OUTLIER -137.28 -142.52 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.163 -0.961 . . . . 0.0 109.396 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 24.6 tpt180 -112.26 100.59 8.93 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.059 -1.026 . . . . 0.0 109.155 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 83.96 77.28 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.419 0.628 . . . . 0.0 109.842 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.498 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 10.3 mmt -125.11 -40.39 2.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.87 . . . . 0.0 108.815 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.2 m-85 70.69 52.51 0.31 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.496 -0.753 . . . . 0.0 110.942 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.498 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -116.76 -23.85 7.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 108.621 178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 38.7 m -50.79 126.88 16.97 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.897 0.856 . . . . 0.0 109.605 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.563 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 4.1 t -58.22 -27.38 63.87 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.217 0.532 . . . . 0.0 109.638 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' A' ' 17' ' ' THR . 5.1 t -154.34 75.55 1.0 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.214 -0.929 . . . . 0.0 109.698 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 149.5 -167.16 29.71 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.6 m -127.37 -164.55 1.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -1.163 . . . . 0.0 109.715 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.7 m -79.43 116.34 19.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -114.79 115.79 27.57 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.284 -0.885 . . . . 0.0 109.457 179.458 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 66.04 33.94 7.29 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.433 -0.792 . . . . 0.0 110.12 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -11.38 59.87 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 21' ' ' ARG . 12.1 mttt -115.43 -175.55 2.73 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.099 -1.236 . . . . 0.0 109.371 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.79 172.24 11.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.463 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 119.904 -1.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.539 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.21 0.529 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.522 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 1.2 mptm? -83.52 157.67 22.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 109.96 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -90.46 157.95 26.06 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -49.46 157.88 0.47 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.123 -1.222 . . . . 0.0 110.234 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.56 7.48 15.27 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.26 24.75 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.021 -1.281 . . . . 0.0 110.833 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.41 156.17 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.063 -1.023 . . . . 0.0 110.598 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 22.1 p 177.47 -165.57 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.548 -0.72 . . . . 0.0 109.745 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.437 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 8.4 t -101.53 -145.14 0.35 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.395 -0.816 . . . . 0.0 109.295 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.461 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -95.0 -24.22 17.03 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.099 -1.001 . . . . 0.0 109.7 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 1.014 HD23 ' OH ' ' A' ' 13' ' ' TYR . 2.7 mp -133.08 -105.91 0.25 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.9 OUTLIER 67.41 -58.16 0.43 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.895 -1.128 . . . . 0.0 109.846 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 1.014 ' OH ' HD23 ' A' ' 11' ' ' LEU . 42.8 m-85 71.02 45.49 0.51 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.434 -0.791 . . . . 0.0 109.725 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 3.3 m-20 -104.23 -20.76 13.68 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.111 -0.993 . . . . 0.0 109.231 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.5 m -47.42 127.11 10.64 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.814 . . . . 0.0 109.532 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.539 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 5.0 t -66.18 -13.15 59.78 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.395 0.617 . . . . 0.0 109.522 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.11 117.64 4.62 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.405 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.33 -153.12 24.96 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 31.7 t -137.09 -158.96 0.91 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.195 -1.18 . . . . 0.0 109.56 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 6.3 m -83.0 114.71 21.45 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.244 -0.91 . . . . 0.0 109.647 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 23.4 mtp180 -104.57 117.46 34.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.1 -1.0 . . . . 0.0 109.488 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.462 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 3.1 m 59.84 13.49 3.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.506 -0.747 . . . . 0.0 109.837 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.447 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 111.83 -24.12 15.64 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.2 mtmt -96.03 169.36 10.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -1.162 . . . . 0.0 109.661 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.45 167.76 20.61 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.186 -0.946 . . . . 0.0 109.49 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.416 0 O-C-N 119.859 -1.776 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.568 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.269 0.557 . . . . 0.0 109.584 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 17.0 mmtt -96.83 170.5 9.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.456 -0.777 . . . . 0.0 109.661 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.09 151.97 18.01 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.523 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.0 OUTLIER -51.85 155.22 1.81 Allowed 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.177 -1.19 . . . . 0.0 110.319 -179.544 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 67.13 0.25 9.41 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 27.25 0.33 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.82 -1.4 . . . . 0.0 110.993 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER 55.79 155.32 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.926 -1.109 . . . . 0.0 110.568 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.8 p 178.84 -175.17 0.2 Allowed 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.38 -0.825 . . . . 0.0 109.974 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 38.9 t -98.68 -142.01 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.364 -0.835 . . . . 0.0 109.233 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -92.34 -62.45 1.4 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.93 -1.106 . . . . 0.0 109.546 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.421 HD23 ' OH ' ' A' ' 13' ' ' TYR . 1.4 mp -123.11 58.87 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.28 -0.887 . . . . 0.0 109.591 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.0 mmm -81.93 -10.32 59.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.164 -0.96 . . . . 0.0 109.507 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.421 ' OH ' HD23 ' A' ' 11' ' ' LEU . 93.0 m-85 48.87 47.94 20.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 109.543 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 1.2 p30 -115.74 -19.55 10.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.1 m -62.38 124.8 21.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.224 -0.922 . . . . 0.0 109.933 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.73 -25.52 66.55 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.356 0.598 . . . . 0.0 109.707 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.14 112.33 4.34 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.162 -0.961 . . . . 0.0 109.558 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.42 -146.06 16.81 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.4 m -149.02 -169.11 3.29 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -1.119 . . . . 0.0 109.446 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.461 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.9 m -81.11 108.65 14.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.506 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 24' ' ' LYS . 18.2 ttt180 -104.57 121.81 44.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.244 -0.91 . . . . 0.0 109.677 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m 52.59 20.59 1.55 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.87 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.44 -21.35 39.49 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mttp -93.67 159.64 15.12 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.197 -1.178 . . . . 0.0 109.616 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.494 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -72.05 167.93 19.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.186 -0.946 . . . . 0.0 109.632 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.523 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.304 -1.401 0 O-C-N 119.947 -1.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.302 0.572 . . . . 0.0 109.552 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -84.36 158.96 20.97 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 109.54 -179.851 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.3 162.66 17.97 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HD2' HG21 ' A' ' 17' ' ' THR . 0.0 OUTLIER -55.64 149.47 14.04 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.079 -1.248 . . . . 0.0 109.667 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.84 -23.37 29.14 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.541 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.3 74.78 3.86 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.737 -0.861 . . . . 0.0 108.966 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -22.51 145.09 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.854 0.835 . . . . 0.0 112.081 -179.247 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.4 p -147.75 -166.49 2.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 110.112 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.4 t -93.92 -122.87 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.347 -0.846 . . . . 0.0 109.27 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.487 ' HG3' HD12 ' A' ' 11' ' ' LEU . 0.9 OUTLIER -118.75 -61.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.719 -1.238 . . . . 0.0 109.756 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.643 HD23 ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -123.2 80.88 1.82 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.793 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.7 mmm -114.27 -25.33 8.5 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.187 -0.946 . . . . 0.0 109.156 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.643 ' OH ' HD23 ' A' ' 11' ' ' LEU . 29.1 m-85 70.29 38.13 1.48 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.357 -0.84 . . . . 0.0 109.656 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB2' ' HE2' ' A' ' 2' ' ' LYS . 1.1 p30 -103.33 -36.24 8.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.222 -0.924 . . . . 0.0 109.218 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.3 m -49.53 125.72 11.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.0 109.409 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -66.65 -15.06 63.21 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 121.312 0.577 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.474 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 5.4 t -99.42 -144.57 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 0.0 109.125 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.474 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -50.42 -99.43 0.01 OUTLIER Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.413 ' O ' ' C ' ' A' ' 20' ' ' CYS . 21.3 p -151.54 176.07 11.69 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.078 -1.248 . . . . 0.0 109.432 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.4 m -44.28 129.1 6.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 109.303 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 1.2 ttt180 -131.47 140.93 49.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.033 -1.042 . . . . 0.0 109.491 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m 47.43 24.64 0.5 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.178 -0.951 . . . . 0.0 109.271 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.34 -23.68 17.5 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -105.57 165.61 11.03 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -1.172 . . . . 0.0 109.914 -179.774 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.27 158.36 35.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.148 -0.97 . . . . 0.0 109.467 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.414 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.303 -1.445 0 O-C-N 119.991 -1.693 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.53 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 25.4 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.302 0.572 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmtm -113.21 -167.11 1.15 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.33 -0.857 . . . . 0.0 110.77 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.35 -178.01 15.19 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.93 151.23 15.09 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.084 -1.244 . . . . 0.0 109.59 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.93 -29.79 8.84 Favored Glycine 0 N--CA 1.485 1.959 0 N-CA-C 107.772 -2.131 . . . . 0.0 107.772 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.42 73.89 0.36 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.59 150.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.311 0.577 . . . . 0.0 110.371 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 23' ' ' GLY . 29.8 p -159.51 -163.57 1.2 Allowed 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.202 -0.936 . . . . 0.0 109.789 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.459 ' CB ' ' HG3' ' A' ' 12' ' ' MET . 7.7 t -94.99 -125.75 0.12 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.335 -0.853 . . . . 0.0 109.196 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -122.46 -31.38 3.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.748 -1.22 . . . . 0.0 109.748 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.37 19.72 3.99 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.459 ' HG3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -59.12 -25.42 63.82 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.959 -1.088 . . . . 0.0 108.853 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 53.28 80.57 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.87 . . . . 0.0 109.487 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' A' ' 15' ' ' CYS . 4.4 m-20 -136.35 -38.25 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.519 -0.738 . . . . 0.0 109.286 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 14' ' ' ASP . 7.6 m -43.55 124.74 3.67 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.085 0.945 . . . . 0.0 109.535 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.53 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -67.15 -24.15 65.87 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.416 0.627 . . . . 0.0 109.432 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 p -130.62 94.27 3.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.335 -0.853 . . . . 0.0 109.21 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.68 -163.69 15.43 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' CYS . 51.4 p -129.77 171.14 12.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.257 -1.143 . . . . 0.0 109.532 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.1 m -43.61 130.31 5.32 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.203 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -121.2 129.35 53.16 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.158 -0.964 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 43.7 m 48.19 22.62 0.44 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.36 -0.837 . . . . 0.0 109.586 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 102.33 -36.14 4.48 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.3 mttt -95.88 160.16 14.61 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.091 -1.241 . . . . 0.0 109.59 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.15 165.8 8.74 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.055 -1.028 . . . . 0.0 109.326 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.458 0 O-C-N 120.148 -1.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.485 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.256 0.551 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -75.81 158.45 32.16 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.216 -0.927 . . . . 0.0 110.019 -179.724 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.32 158.42 19.95 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 3' ' ' GLY . 0.0 OUTLIER -45.3 156.53 0.11 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.059 -1.26 . . . . 0.0 110.136 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 55.62 11.0 3.57 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -80.92 22.49 0.61 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.808 -1.407 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 56.41 151.33 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.07 -1.019 . . . . 0.0 110.713 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.9 p 177.73 -151.06 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 109.881 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 68.2 m -115.27 -123.48 0.29 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.375 -0.828 . . . . 0.0 109.509 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 21.7 mmm180 -118.17 -41.24 2.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.777 -1.202 . . . . 0.0 109.798 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.58 70.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.194 -0.941 . . . . 0.0 109.623 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.2 mtm -102.56 -7.63 21.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 62.68 52.6 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.61 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -126.81 -9.07 6.09 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.0 109.811 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 83.4 m -72.23 119.65 16.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 4.2 t -68.82 -13.42 62.39 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.577 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 23.2 p -122.44 2.93 9.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.881 -1.137 . . . . 0.0 111.507 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.495 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 169.01 -124.0 1.13 Allowed Glycine 0 N--CA 1.494 2.52 0 C-N-CA 118.927 -1.606 . . . . 0.0 110.491 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -132.83 -161.82 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.434 -1.039 . . . . 0.0 109.714 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.1 m -86.07 128.39 34.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.413 -0.804 . . . . 0.0 110.262 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.0 141.75 50.71 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.326 -0.859 . . . . 0.0 108.819 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.0 t 47.72 23.55 0.44 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.307 -0.87 . . . . 0.0 109.496 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.52 -33.23 5.44 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.6 mttp -96.15 171.66 8.46 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.109 -1.23 . . . . 0.0 109.806 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m -69.03 172.62 6.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 0.0 109.558 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 119.859 -1.776 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.542 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.326 0.584 . . . . 0.0 109.597 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -82.33 157.78 23.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 109.893 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.51 162.0 30.24 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.522 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.57 156.26 3.57 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.028 -1.278 . . . . 0.0 109.819 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 64.79 6.22 22.66 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.0 26.68 0.33 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.912 -1.346 . . . . 0.0 110.7 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.43 155.55 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.283 0 O-C-N 120.979 -1.076 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 16.5 p -179.2 -158.67 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.38 -0.825 . . . . 0.0 109.745 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 3.5 t -106.96 -102.37 0.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.648 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.461 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.0 ttt180 -140.23 -44.36 0.42 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.075 -1.016 . . . . 0.0 109.857 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.22 39.01 1.92 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.846 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.503 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 7.9 mmt -78.78 -22.48 46.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.074 -1.016 . . . . 0.0 109.156 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 38.9 m-85 60.85 73.14 0.49 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -0.871 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' HB2' ' A' ' 12' ' ' MET . 0.0 OUTLIER -134.94 9.58 3.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.322 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 18.5 m -86.13 125.41 33.47 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.178 -0.951 . . . . 0.0 109.794 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.542 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -66.7 -23.89 66.18 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.717 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -153.18 72.04 0.93 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.16 -0.963 . . . . 0.0 109.667 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 150.99 -167.96 30.63 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.3 t -138.55 161.32 37.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -1.117 . . . . 0.0 109.299 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.3 m -52.08 127.27 21.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.324 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER -139.12 121.75 16.32 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.164 -0.96 . . . . 0.0 109.816 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.55 10.29 4.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 109.908 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.78 -2.44 33.97 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -121.99 174.48 6.88 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.045 -1.268 . . . . 0.0 109.64 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.81 170.97 14.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.62 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.343 0 O-C-N 119.919 -1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.525 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.6 mmtt -107.48 -166.75 1.18 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.247 -0.908 . . . . 0.0 109.946 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.46 160.54 25.15 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.4 pttp -53.55 152.0 5.37 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.959 -1.318 . . . . 0.0 109.451 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.03 -31.5 7.26 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 107.61 -2.196 . . . . 0.0 107.61 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.33 80.21 3.84 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.9 pttt -28.44 149.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.443 0.639 . . . . 0.0 110.739 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -150.98 -162.32 1.53 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.099 -1.001 . . . . 0.0 109.904 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.51 ' HB2' ' CG ' ' A' ' 12' ' ' MET . 73.2 m -94.07 -101.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.209 -0.932 . . . . 0.0 109.703 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -167.48 115.65 0.79 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.509 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 76.02 16.06 2.36 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.322 -0.861 . . . . 0.0 109.612 179.813 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.51 ' CG ' ' HB2' ' A' ' 9' ' ' SER . 36.4 mmt -74.17 -9.31 58.49 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.123 -0.986 . . . . 0.0 109.265 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 12' ' ' MET . 19.2 m-85 42.52 57.05 3.58 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -0.852 . . . . 0.0 109.549 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -116.55 -22.08 8.87 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.28 -0.887 . . . . 0.0 109.24 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.8 m -61.76 124.25 20.21 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.192 0.996 . . . . 0.0 109.837 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.525 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -66.9 -36.94 83.41 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.72 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 t -128.9 72.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.337 -0.852 . . . . 0.0 109.408 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.63 -158.3 26.54 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 p -148.63 168.16 23.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.101 . . . . 0.0 109.376 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 8.6 m -57.65 92.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.345 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 24' ' ' LYS . 8.8 ttm180 -103.7 135.23 45.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.325 -0.859 . . . . 0.0 109.403 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 t 58.6 22.13 9.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.247 -0.908 . . . . 0.0 109.379 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.13 -14.77 61.3 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 32.3 mttm -107.15 172.48 6.8 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.12 -1.223 . . . . 0.0 109.518 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.46 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -72.2 169.15 16.74 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.096 -1.003 . . . . 0.0 109.217 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.517 0 O-C-N 120.058 -1.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.576 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.279 0.561 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 15.4 mmtm -122.52 -167.65 1.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 109.838 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.431 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -143.72 161.88 27.74 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -41.1 148.52 0.11 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.365 -1.08 . . . . 0.0 110.107 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.97 -34.18 5.09 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 107.963 -2.055 . . . . 0.0 107.963 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.62 80.57 4.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.591 -0.946 . . . . 0.0 108.785 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -33.09 155.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.248 0.547 . . . . 0.0 110.39 -179.567 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -142.48 -145.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.032 -1.043 . . . . 0.0 109.904 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.541 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -111.95 7.16 19.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.816 -1.178 . . . . 0.0 110.351 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.547 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 0.0 OUTLIER 82.95 -13.62 0.8 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.638 -0.664 . . . . 0.0 109.772 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.06 22.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.044 -1.035 . . . . 0.0 109.503 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -83.25 -21.13 33.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.183 -0.948 . . . . 0.0 109.049 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.7 m-85 61.95 66.95 0.78 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.888 . . . . 0.0 109.837 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 15.9 p-10 -118.3 -20.25 8.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.189 -0.945 . . . . 0.0 109.257 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -60.68 127.38 31.39 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.919 0.866 . . . . 0.0 109.22 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.576 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -61.87 -41.1 97.45 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -131.6 120.75 23.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.409 -0.807 . . . . 0.0 108.977 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.18 -152.51 17.05 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.299 -1.52 . . . . 0.0 109.299 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 m -150.92 161.04 43.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.086 -1.244 . . . . 0.0 109.711 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -48.51 117.56 2.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 0.0 109.262 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.8 ttm180 -113.65 136.32 52.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.043 -1.036 . . . . 0.0 109.333 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 49.26 27.32 1.82 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 109.437 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.36 -22.22 21.06 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 7.1 mtmt -100.35 168.42 9.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.172 -1.193 . . . . 0.0 109.651 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -72.63 168.75 18.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.936 -1.102 . . . . 0.0 108.829 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.406 0 O-C-N 120.059 -1.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.395 0.617 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.528 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -71.11 159.67 34.28 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.318 -0.864 . . . . 0.0 109.603 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.66 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -105.15 168.96 16.02 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -55.73 163.12 1.47 Allowed 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.086 -1.244 . . . . 0.0 109.655 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 43.84 25.1 0.56 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.59 21.86 0.49 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -1.126 . . . . 0.0 111.119 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' C ' ' O ' ' A' ' 6' ' ' ALA . 12.1 pttm 34.72 43.1 0.09 Allowed 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.992 0.901 . . . . 0.0 109.624 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.64 ' N ' ' O ' ' A' ' 23' ' ' GLY . 20.7 p -68.52 -148.95 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 CA-C-O 121.44 0.638 . . . . 0.0 109.923 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 0.6 OUTLIER -106.53 -140.45 0.37 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.575 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.483 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ttp180 -132.98 116.48 16.47 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.111 -0.993 . . . . 0.0 108.889 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER 63.42 45.57 4.78 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.723 -0.61 . . . . 0.0 109.854 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.483 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 1.4 mmm -100.06 -5.37 28.11 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.379 -0.826 . . . . 0.0 109.235 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 55.07 53.4 10.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.358 -0.839 . . . . 0.0 109.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.497 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 56.2 m-20 -124.12 -28.89 3.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.268 -0.895 . . . . 0.0 109.715 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 89.2 m -44.65 125.3 4.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 109.367 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -64.38 -28.69 69.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.41 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.455 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.3 p -153.66 31.8 0.46 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.024 -1.047 . . . . 0.0 109.73 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -154.9 -159.62 9.39 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' N ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -133.97 122.91 23.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -1.074 . . . . 0.0 109.219 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' SER . 1.6 m -43.01 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.53 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -113.32 137.82 50.94 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.182 -0.948 . . . . 0.0 109.268 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.47 24.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.042 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.64 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 87.0 -21.47 19.75 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 23.7 mttt -93.09 134.07 35.62 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.839 -1.389 . . . . 0.0 109.117 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -66.54 163.97 17.55 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 121.568 -0.708 . . . . 0.0 109.526 -179.721 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.563 0 O-C-N 120.122 -1.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.556 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.318 0.58 . . . . 0.0 109.489 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -88.79 166.25 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.266 -0.896 . . . . 0.0 109.701 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -118.67 153.02 17.17 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -42.43 147.83 0.25 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -1.104 . . . . 0.0 110.02 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.97 -29.34 8.79 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.86 75.17 0.46 Allowed 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.541 -0.976 . . . . 0.0 108.529 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.26 149.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.614 0.721 . . . . 0.0 110.586 -179.611 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -152.11 -156.96 0.75 Allowed 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.213 -0.93 . . . . 0.0 109.799 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.481 ' HB3' ' HG2' ' A' ' 12' ' ' MET . 10.7 t -93.42 -110.86 0.11 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.289 -0.882 . . . . 0.0 109.52 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' OG ' ' A' ' 9' ' ' SER . 52.4 ttt180 -135.35 -45.7 0.69 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.775 -1.203 . . . . 0.0 110.024 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.16 45.57 2.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.006 -1.059 . . . . 0.0 109.951 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' HB3' ' A' ' 9' ' ' SER . 14.5 mmt -80.36 -36.98 33.3 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.069 -1.02 . . . . 0.0 109.058 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.416 ' HB2' ' O ' ' A' ' 12' ' ' MET . 5.0 m-30 60.16 35.24 21.13 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.43 -0.794 . . . . 0.0 109.989 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -94.96 -12.15 27.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.123 -0.985 . . . . 0.0 108.962 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.2 m -57.61 133.64 55.47 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.105 0.955 . . . . 0.0 109.607 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.556 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.0 t -66.05 -30.38 70.9 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.257 -179.458 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.455 HG23 ' O ' ' A' ' 17' ' ' THR . 1.7 t -142.32 81.0 1.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.952 -1.092 . . . . 0.0 109.952 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.48 -160.0 25.0 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.24 164.58 29.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.409 -1.054 . . . . 0.0 109.388 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 m -50.5 99.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -0.937 . . . . 0.0 109.521 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -112.98 145.93 39.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.139 -0.976 . . . . 0.0 109.746 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.7 t 55.31 26.33 8.49 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.443 -0.786 . . . . 0.0 109.519 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.67 -6.97 59.88 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -121.03 179.36 4.4 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.485 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.62 166.76 22.68 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.954 179.421 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.622 0 O-C-N 120.151 -1.593 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 4.1 p . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.291 0.567 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.6 mmtp -106.94 -176.77 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.21 -0.931 . . . . 0.0 110.107 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.54 163.91 12.66 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -50.25 156.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.948 -1.324 . . . . 0.0 109.19 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.66 -32.08 6.33 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -74.04 77.23 1.71 Allowed 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 178.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -30.71 150.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 121.338 0.589 . . . . 0.0 110.338 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -146.79 -166.09 2.41 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.986 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -94.31 -102.63 0.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.327 -0.858 . . . . 0.0 109.611 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.1 ttm180 -148.31 112.92 5.35 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.158 -0.964 . . . . 0.0 109.174 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.5 mt 64.01 28.25 14.34 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.445 -0.784 . . . . 0.0 109.453 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 2.5 mmt -58.74 -21.71 56.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.315 -0.866 . . . . 0.0 109.447 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' MET . 40.5 m-85 59.27 33.96 22.81 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.739 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -110.41 -30.48 7.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.253 -0.905 . . . . 0.0 109.241 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -54.37 124.43 15.95 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 122.214 1.007 . . . . 0.0 109.042 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.7 t -66.8 -25.09 66.29 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.759 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 18' ' ' GLY . 54.5 p -90.73 -128.84 0.09 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.237 -0.915 . . . . 0.0 109.089 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.9 -119.33 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.0 p -146.52 175.45 10.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.126 -1.22 . . . . 0.0 109.456 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.3 m -45.39 103.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.236 -0.915 . . . . 0.0 109.462 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.11 133.33 50.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 109.334 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.27 22.86 2.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.136 -0.978 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.43 -19.52 46.83 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.1 mtpt -101.22 159.46 15.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -1.162 . . . . 0.0 109.384 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.11 163.99 16.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.077 -1.014 . . . . 0.0 109.113 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.469 0 O-C-N 119.999 -1.688 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.574 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.222 0.534 . . . . 0.0 109.759 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 27.0 mmtm -81.52 -171.73 3.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.301 -0.875 . . . . 0.0 109.618 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.709 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -122.79 161.92 16.81 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -58.75 162.67 3.83 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.295 -1.121 . . . . 0.0 109.777 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 47.79 24.14 2.8 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.709 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.62 21.87 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.321 -1.105 . . . . 0.0 111.479 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.515 ' C ' ' O ' ' A' ' 6' ' ' ALA . 19.9 ptmt 30.79 44.65 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 121.887 0.851 . . . . 0.0 110.11 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.61 ' N ' ' O ' ' A' ' 23' ' ' GLY . 29.7 p -70.63 -153.64 0.02 OUTLIER 'General case' 0 C--N 1.29 -2.012 0 O-C-N 121.815 -0.553 . . . . 0.0 109.869 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.451 ' O ' ' HA2' ' A' ' 23' ' ' GLY . 1.4 t -103.26 -140.93 0.36 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 109.868 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.544 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.6 OUTLIER -128.43 108.43 10.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.067 -1.021 . . . . 0.0 109.148 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.544 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 80.2 53.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.555 -0.716 . . . . 0.0 109.52 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.8 mmm -103.27 -16.44 15.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.944 . . . . 0.0 109.289 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 57.09 50.7 11.51 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' C ' ' A' ' 15' ' ' CYS . 1.0 OUTLIER -124.13 -27.24 3.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.717 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.48 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 64.8 m -45.47 123.08 3.92 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 122.122 0.963 . . . . 0.0 109.763 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.574 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.7 t -67.28 -9.95 45.96 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.077 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.8 p -130.2 -5.13 4.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.716 -1.24 . . . . 0.0 111.006 -178.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.48 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . -170.24 -127.84 0.97 Allowed Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.377 -1.392 . . . . 0.0 110.023 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.422 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 33.0 t -140.58 162.68 34.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.274 -1.133 . . . . 0.0 109.519 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.3 m -51.11 126.56 16.82 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.91 . . . . 0.0 109.636 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.13 123.35 40.11 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.165 -0.959 . . . . 0.0 109.061 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.75 27.45 4.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 108.765 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.61 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 91.06 -32.7 5.02 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 1.4 mttm -92.73 135.85 33.74 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.366 -1.079 . . . . 0.0 109.277 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.6 OUTLIER -57.39 165.8 1.4 Allowed 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.482 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.518 0 O-C-N 120.053 -1.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.557 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.479 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 2.5 mptt -81.84 161.7 23.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.324 -0.86 . . . . 0.0 110.115 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -109.19 161.68 13.03 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 108.812 -1.715 . . . . 0.0 108.812 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -41.37 150.47 0.09 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.289 -1.124 . . . . 0.0 109.926 -179.615 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 96.22 -31.57 7.26 Favored Glycine 0 N--CA 1.487 2.069 0 N-CA-C 107.881 -2.087 . . . . 0.0 107.881 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.11 75.89 0.34 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -28.93 150.09 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.399 0.619 . . . . 0.0 110.475 -179.418 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.9 p -157.16 -161.67 1.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.136 -0.978 . . . . 0.0 109.735 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 86.9 p -98.84 -143.72 0.32 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.296 -0.877 . . . . 0.0 109.425 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -30.22 18.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.0 109.445 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.3 mt -153.84 44.07 0.58 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.177 -0.952 . . . . 0.0 109.956 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -53.31 -23.68 9.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.065 -1.022 . . . . 0.0 109.162 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 12' ' ' MET . 10.7 m-85 63.67 36.1 11.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.622 179.254 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.03 -25.47 5.77 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.087 -1.008 . . . . 0.0 109.304 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.8 m -52.93 126.21 19.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.987 . . . . 0.0 109.157 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.557 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.87 -28.04 68.01 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.349 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.98 135.65 47.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.066 -1.021 . . . . 0.0 109.719 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.26 -176.29 3.89 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.26 -171.83 1.94 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.28 -1.129 . . . . 0.0 109.47 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 9' ' ' SER . 9.0 m -61.37 103.34 0.3 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.303 -0.873 . . . . 0.0 109.446 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . 28.6 tpt180 -97.81 135.72 39.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 t 51.5 32.52 8.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.278 -0.889 . . . . 0.0 109.718 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.27 -9.7 46.59 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -110.94 172.02 7.12 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.015 -1.286 . . . . 0.0 109.552 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m -73.26 168.58 18.87 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.46 -0.896 . . . . 0.0 108.839 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.074 -1.641 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 7.5 p . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 121.303 0.573 . . . . 0.0 109.535 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 16.5 mmtt -99.04 168.96 9.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 109.91 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.45 169.43 20.47 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.02 156.97 13.68 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.177 -1.19 . . . . 0.0 110.102 -179.548 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 70.9 -0.87 26.94 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.06 22.03 0.54 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.971 -1.311 . . . . 0.0 110.963 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.88 154.17 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.941 -1.099 . . . . 0.0 110.46 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 30.9 p 175.14 173.95 0.23 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.482 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -93.33 -163.36 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.1 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' CG ' HH11 ' A' ' 10' ' ' ARG . 0.0 OUTLIER -60.61 -61.44 2.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.031 -1.043 . . . . 0.0 109.519 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' CZ ' ' A' ' 13' ' ' TYR . 2.6 mp -138.04 72.63 1.42 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.274 -0.891 . . . . 0.0 109.614 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.493 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -86.57 -14.9 41.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.105 -0.997 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.493 ' CD2' ' O ' ' A' ' 12' ' ' MET . 3.9 m-85 69.29 54.73 0.41 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.517 ' N ' ' OD1' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -130.23 -11.19 4.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.136 -0.977 . . . . 0.0 110.134 -179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.1 m -73.15 124.62 25.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.118 -0.989 . . . . 0.0 109.882 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -67.09 -27.4 67.32 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 121.369 0.604 . . . . 0.0 109.42 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' THR . 4.5 t -150.91 126.85 10.39 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.261 -0.899 . . . . 0.0 109.281 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.26 -166.93 28.61 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.07 -167.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -1.147 . . . . 0.0 109.673 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.482 ' SG ' ' O ' ' A' ' 9' ' ' SER . 6.9 m -85.43 117.38 24.31 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.361 -0.837 . . . . 0.0 109.728 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 24' ' ' LYS . 4.2 ttt180 -122.67 131.01 53.61 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.167 -0.958 . . . . 0.0 109.268 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 57.41 28.18 15.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.294 -0.879 . . . . 0.0 109.208 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.93 7.63 88.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 10.5 mtpt -120.26 162.34 19.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.191 -1.182 . . . . 0.0 110.0 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m -73.63 167.58 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.462 -0.774 . . . . 0.0 109.301 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.392 0 O-C-N 119.923 -1.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -111.15 168.62 9.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.86 . . . . 0.0 109.976 -179.629 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.2 165.17 25.06 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.424 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.8 153.55 24.17 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.094 -1.239 . . . . 0.0 110.109 -179.706 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.71 2.73 12.47 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.12 28.64 0.29 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.825 -1.397 . . . . 0.0 110.902 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.56 157.04 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.893 -1.13 . . . . 0.0 110.358 -179.958 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.2 p 179.23 -174.06 0.2 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.432 -0.793 . . . . 0.0 109.961 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.2 t -94.48 -118.52 0.1 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.248 -0.907 . . . . 0.0 109.404 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -119.86 -76.65 0.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.915 -1.116 . . . . 0.0 109.679 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.573 HD23 ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -111.76 28.51 8.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.054 -1.029 . . . . 0.0 109.756 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mmt -59.09 -22.65 61.15 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.295 -0.878 . . . . 0.0 109.204 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.0 m-85 62.76 56.61 1.9 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.405 -0.81 . . . . 0.0 109.845 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.428 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 75.2 m-20 -114.38 -37.94 4.21 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 28.4 m -44.1 125.03 4.2 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 109.544 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.2 t -66.81 -10.09 44.1 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.936 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 18' ' ' GLY . 17.6 p -146.21 -106.65 0.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.891 . . . . 0.0 109.556 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -43.82 167.16 0.02 OUTLIER Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 p -94.94 -168.85 1.88 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.204 -1.174 . . . . 0.0 109.614 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.0 m -81.92 117.52 22.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.315 -0.865 . . . . 0.0 109.792 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.27 113.44 26.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.129 -0.982 . . . . 0.0 109.324 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 16.35 2.01 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.686 -0.634 . . . . 0.0 109.804 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 112.18 -19.11 22.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.1 mtpp -93.48 151.92 19.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.099 -1.236 . . . . 0.0 109.637 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -73.32 168.04 20.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 109.55 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.57 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.5 p . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.354 0.597 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HA ' ' CE ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -90.48 -169.4 2.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.534 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -121.18 153.2 16.67 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 6' ' ' ALA . 1.2 ttmt -48.84 152.77 0.95 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.935 -1.332 . . . . 0.0 109.958 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 45.95 18.03 0.23 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -81.36 26.17 0.47 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.318 . . . . 0.0 110.715 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.77 157.9 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.042 -1.036 . . . . 0.0 110.284 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 15.5 p -179.48 -157.64 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.352 -0.842 . . . . 0.0 110.115 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.85 -89.27 0.58 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.402 -0.811 . . . . 0.0 109.739 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.505 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -141.41 -118.72 0.11 Allowed 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.421 -0.799 . . . . 0.0 109.861 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.8 mm? -79.01 52.9 1.33 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.737 -1.227 . . . . 0.0 110.02 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.7 mmm -75.78 -13.14 60.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.134 -0.979 . . . . 0.0 109.003 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 53.32 47.02 25.17 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.393 -0.817 . . . . 0.0 109.968 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' CYS . 12.7 t0 -110.87 -30.04 7.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 109.235 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 19' ' ' SER . 74.4 m -43.58 124.19 3.44 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.093 0.949 . . . . 0.0 109.404 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.57 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.77 -22.99 66.02 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 17' ' ' THR . 10.4 t -153.96 54.5 0.71 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.967 . . . . 0.0 109.746 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 167.39 -147.51 11.86 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 26' ' ' NH2 . 28.3 t -146.26 -162.8 1.6 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.337 -1.096 . . . . 0.0 109.526 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.0 m -94.43 105.3 17.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.744 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.7 OUTLIER -119.38 131.89 55.75 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.203 -0.935 . . . . 0.0 109.061 179.665 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.407 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 22.7 t 62.5 14.82 7.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.323 -0.861 . . . . 0.0 109.322 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.441 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.16 -23.87 34.29 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.2 mtmm -100.55 170.16 8.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.21 -1.171 . . . . 0.0 109.934 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.37 167.16 15.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.549 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.499 ' N ' ' O ' ' A' ' 19' ' ' SER . . . . . . . . 0 C--N 1.302 -1.48 0 O-C-N 120.066 -1.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.562 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.388 0.613 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 2.7 mptp? -84.84 -174.97 5.56 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.0 109.843 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.21 169.56 14.91 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.495 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.7 mtpt -57.21 150.75 17.03 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.103 -1.233 . . . . 0.0 109.959 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.36 -4.87 38.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.9 25.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.245 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.62 157.59 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 O-C-N 120.941 -1.099 . . . . 0.0 110.884 179.835 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.0 p -179.9 -157.47 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.438 -0.789 . . . . 0.0 109.789 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.511 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 0.3 OUTLIER -116.78 -82.79 0.63 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.924 . . . . 0.0 109.548 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.527 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -156.96 -66.65 0.1 Allowed 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.428 -0.795 . . . . 0.0 109.902 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.428 HD12 ' HB3' ' A' ' 10' ' ' ARG . 2.3 mp -107.51 24.58 12.67 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.094 -1.004 . . . . 0.0 109.955 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.511 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 0.0 OUTLIER -57.25 -26.64 61.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.171 -0.956 . . . . 0.0 108.9 179.536 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 49.32 33.44 5.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.495 -0.753 . . . . 0.0 110.073 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.52 -24.56 16.01 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.122 -0.986 . . . . 0.0 108.924 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 m -51.84 125.07 14.1 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 122.19 0.995 . . . . 0.0 109.568 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.562 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.4 t -67.0 -12.56 60.21 Favored 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.6 p -106.07 -122.23 0.23 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.219 -0.926 . . . . 0.0 109.745 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.21 -129.58 0.08 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -120.85 -171.68 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.276 -1.132 . . . . 0.0 109.7 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.8 m -63.22 155.24 28.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.684 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.413 ' N ' ' O ' ' A' ' 24' ' ' LYS . 60.3 ttt180 -146.08 124.46 12.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.333 -0.855 . . . . 0.0 109.334 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.1 m 52.1 24.61 2.79 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.846 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.452 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.13 -24.24 32.69 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.3 mttt -93.95 177.39 6.0 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.048 -1.266 . . . . 0.0 109.544 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -73.3 -176.89 2.35 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.579 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.364 0 O-C-N 119.9 -1.75 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.294 0.568 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -113.68 168.53 9.69 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.274 -0.891 . . . . 0.0 109.552 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.41 154.35 17.14 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -55.33 155.42 5.13 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.967 -1.313 . . . . 0.0 109.748 -179.765 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.5 -13.32 11.86 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.524 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.16 37.74 0.33 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.82 -1.4 . . . . 0.0 111.097 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 mttp 50.57 167.94 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.5 p 179.17 -175.54 0.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.076 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.484 ' O ' ' HD3' ' A' ' 10' ' ' ARG . 2.9 m -105.26 -103.74 0.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.355 -0.84 . . . . 0.0 109.514 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 9' ' ' SER . 3.2 mmt180 -128.26 -106.99 0.3 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.038 -1.039 . . . . 0.0 109.592 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.55 70.01 3.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.736 -1.228 . . . . 0.0 109.606 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 19.2 mmt -97.66 -31.71 12.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -0.906 . . . . 0.0 109.547 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' CB ' ' O ' ' A' ' 12' ' ' MET . 3.1 m-85 77.56 40.91 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.5 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.468 ' OD2' ' HB2' ' A' ' 12' ' ' MET . 2.9 m-20 -96.48 -25.47 15.65 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.133 -0.979 . . . . 0.0 109.236 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 33.2 m -55.54 127.03 27.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.218 -0.926 . . . . 0.0 109.776 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -65.76 -30.58 71.26 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.542 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.412 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.2 p -150.55 37.49 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.003 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -164.94 -155.52 8.52 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 p -147.93 167.91 23.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.35 -1.088 . . . . 0.0 109.047 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 1.6 m -56.03 125.06 19.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.105 -0.997 . . . . 0.0 109.215 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -121.2 100.22 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.173 -0.954 . . . . 0.0 109.689 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.98 2.21 3.48 Favored 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.84 -0.538 . . . . 0.0 110.316 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.458 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 137.74 -30.24 2.59 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 119.587 -1.292 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -102.73 177.31 4.89 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.995 -1.297 . . . . 0.0 109.998 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.493 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -74.56 168.51 19.63 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.421 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.448 0 O-C-N 119.939 -1.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.396 0.617 . . . . 0.0 109.609 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -104.61 165.09 11.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.901 . . . . 0.0 109.759 -179.775 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.43 165.0 16.66 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 8.3 mtpp -59.96 150.08 30.01 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.123 -1.222 . . . . 0.0 110.389 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 57.14 9.05 3.76 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.77 27.68 0.37 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.727 -1.454 . . . . 0.0 110.647 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.72 154.46 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 O-C-N 121.039 -1.038 . . . . 0.0 110.894 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 14.9 p -178.71 -158.19 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.8 p -98.0 -131.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.366 -0.834 . . . . 0.0 109.496 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 11' ' ' LEU . 65.9 mtm180 -134.63 -0.5 2.88 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.786 -1.196 . . . . 0.0 110.382 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -174.44 35.12 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.785 -1.197 . . . . 0.0 110.566 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.445 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -91.22 -19.57 22.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.17 -0.956 . . . . 0.0 108.793 179.25 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.1 m-85 61.61 57.92 2.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.468 -0.77 . . . . 0.0 110.253 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 0.8 OUTLIER -106.82 -11.05 15.86 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.224 -0.922 . . . . 0.0 109.014 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 72.8 m -57.82 125.76 24.45 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 122.05 0.929 . . . . 0.0 110.026 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.9 t -57.96 -33.01 68.39 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.967 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -143.27 -22.03 0.62 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.06 -1.025 . . . . 0.0 111.276 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -101.69 -148.33 21.2 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 26' ' ' NH2 . 66.1 p -140.25 -174.17 3.87 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.426 -1.044 . . . . 0.0 108.994 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 m -91.78 96.18 10.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.02 -1.05 . . . . 0.0 109.395 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 143.78 50.67 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 65.2 28.61 12.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.284 -0.885 . . . . 0.0 109.578 -180.0 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.99 11.65 67.04 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.2 mtmm -140.83 173.3 11.62 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.32 165.33 25.26 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.101 179.806 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.509 ' N ' ' O ' ' A' ' 19' ' ' SER . . . . . . . . 0 C--N 1.299 -1.605 0 O-C-N 120.063 -1.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.54 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.269 0.556 . . . . 0.0 109.515 . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 11.7 mmtt -95.11 -172.4 2.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.387 -0.821 . . . . 0.0 109.962 -179.51 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.439 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -139.73 157.54 25.28 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -43.65 152.05 0.17 Allowed 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.294 -1.121 . . . . 0.0 109.699 -179.856 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.18 -30.27 6.45 Favored Glycine 0 N--CA 1.485 1.955 0 N-CA-C 108.245 -1.942 . . . . 0.0 108.245 -179.055 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.07 76.19 3.63 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.459 -1.024 . . . . 0.0 108.533 179.248 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.47 153.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.177 0.513 . . . . 0.0 110.222 -179.652 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 24.6 p -144.28 -160.48 1.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.071 -1.018 . . . . 0.0 109.518 -179.555 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.02 -83.7 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.127 -0.983 . . . . 0.0 109.459 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -175.18 105.82 0.09 Allowed 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.469 -0.77 . . . . 0.0 109.64 -179.975 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 70.06 44.33 0.8 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.328 -0.858 . . . . 0.0 109.899 179.807 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.464 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 13.5 mmm -90.52 -15.61 30.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 109.0 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 55.62 59.29 3.94 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.726 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 5.1 m-20 -124.21 -30.18 3.48 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.194 -0.941 . . . . 0.0 109.523 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 12.2 m -49.56 125.0 10.46 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 122.066 0.936 . . . . 0.0 109.348 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.54 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.5 t -66.77 -14.65 62.85 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.125 -179.558 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 t -119.71 31.73 6.41 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.085 -1.009 . . . . 0.0 109.862 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 141.98 -150.89 22.42 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 179.771 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 20' ' ' CYS . 7.5 p -124.16 175.88 6.74 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.364 -1.08 . . . . 0.0 109.288 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 19' ' ' SER . 16.8 m -44.58 147.11 0.63 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.205 -0.934 . . . . 0.0 109.62 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.1 ttt180 -123.6 100.8 6.98 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -0.822 . . . . 0.0 108.841 179.377 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 p 59.89 12.89 3.29 Favored 'General case' 0 C--N 1.292 -1.903 0 O-C-N 121.801 -0.562 . . . . 0.0 110.045 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.46 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 127.92 -37.71 2.25 Favored Glycine 0 N--CA 1.493 2.457 0 C-N-CA 119.803 -1.189 . . . . 0.0 110.241 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -103.07 162.59 12.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.1 -1.235 . . . . 0.0 109.86 -179.509 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -67.16 165.32 16.24 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.823 -1.173 . . . . 0.0 109.012 179.799 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.53 0 O-C-N 120.173 -1.579 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.55 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -116.36 -167.49 1.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.195 -0.94 . . . . 0.0 110.332 -179.015 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.02 161.46 25.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.479 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -59.53 152.78 21.12 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.421 . . . . 0.0 109.37 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.58 -34.73 4.68 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 107.311 -2.316 . . . . 0.0 107.311 -178.665 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.39 83.33 3.83 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.67 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.57 152.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.361 0.6 . . . . 0.0 110.527 -179.549 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -156.95 -156.18 0.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.02 -1.05 . . . . 0.0 109.848 -179.303 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -93.73 -137.29 0.2 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 -179.754 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 2.6 mtp180 -134.77 112.79 11.02 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 120.923 -1.11 . . . . 0.0 109.191 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.6 mp 63.64 65.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.618 -0.676 . . . . 0.0 109.564 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.466 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -116.68 -16.62 10.68 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.417 -0.802 . . . . 0.0 109.23 179.828 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 18.0 m-85 66.26 43.84 2.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -0.856 . . . . 0.0 109.889 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 11.8 m-20 -110.83 -34.04 6.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.179 -0.951 . . . . 0.0 109.465 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 27.2 m -52.45 124.22 12.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.142 -0.974 . . . . 0.0 109.207 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.55 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.34 -24.28 66.5 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.656 -179.548 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.99 83.75 2.0 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.305 -0.872 . . . . 0.0 109.491 179.903 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.88 -154.76 16.71 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 t -147.44 158.0 43.8 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.245 -1.15 . . . . 0.0 109.488 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 19.7 m -45.75 103.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.837 . . . . 0.0 109.382 -179.971 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . 38.9 ttp180 -111.9 136.04 51.72 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.093 -1.004 . . . . 0.0 109.453 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.21 14.3 4.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.368 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.31 -23.49 35.1 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -104.65 176.38 5.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.172 -1.193 . . . . 0.0 109.798 -179.914 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.479 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -73.06 170.33 15.11 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.326 -0.95 . . . . 0.0 109.004 179.792 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.493 0 O-C-N 120.083 -1.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -106.07 173.85 6.14 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.218 -0.926 . . . . 0.0 109.655 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -122.81 155.95 17.21 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 2.0 ttmt -41.88 150.82 0.11 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 121.283 -1.128 . . . . 0.0 109.815 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.77 -31.47 6.17 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 108.064 -2.015 . . . . 0.0 108.064 -179.105 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -71.98 75.83 0.92 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.554 -0.968 . . . . 0.0 108.563 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.38 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.223 0.535 . . . . 0.0 110.346 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -148.63 -168.27 3.05 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.017 -1.052 . . . . 0.0 110.09 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.62 -88.97 0.22 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.773 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.682 ' C ' HD22 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -148.52 -74.74 0.18 Allowed 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.505 -0.747 . . . . 0.0 109.528 -179.585 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 10' ' ' ARG . 3.6 mm? -108.87 33.74 4.07 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.718 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.417 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.23 -20.6 66.17 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.148 -0.97 . . . . 0.0 109.336 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 57.2 65.92 1.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.854 . . . . 0.0 109.703 179.775 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.7 OUTLIER -127.77 -32.35 2.36 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.213 -0.929 . . . . 0.0 109.612 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -56.67 126.9 28.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.931 . . . . 0.0 109.259 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.0 t -66.37 -33.92 76.8 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.235 0.54 . . . . 0.0 109.583 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.67 130.82 56.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 109.354 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 58.72 -166.41 7.44 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.431 -1.467 . . . . 0.0 109.431 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' C ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.41 179.65 4.24 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.226 -1.161 . . . . 0.0 109.482 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.408 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.3 m -43.76 130.2 5.55 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.352 -0.843 . . . . 0.0 109.258 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -127.91 123.09 34.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.29 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.71 24.4 14.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.242 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.65 -19.65 39.62 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.1 mttm -109.26 171.9 7.16 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.108 -1.231 . . . . 0.0 109.346 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m -73.06 164.87 26.05 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 119.309 -0.957 . . . . 0.0 109.031 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.444 0 O-C-N 120.042 -1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.517 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.387 0.613 . . . . 0.0 109.544 . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.8 mmtt -88.74 -178.8 5.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 109.877 -179.523 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -135.3 169.43 23.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp -47.3 148.92 1.14 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 120.924 -1.339 . . . . 0.0 109.615 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.21 -33.18 5.23 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 107.831 -2.107 . . . . 0.0 107.831 -178.946 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -70.38 75.25 0.54 Allowed 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 4.0 ptmt -31.76 151.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.451 0.643 . . . . 0.0 110.249 -179.079 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.06 -164.24 1.65 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.17 -0.956 . . . . 0.0 109.542 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -94.06 -164.76 1.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 109.233 179.99 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.558 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -75.72 -25.5 56.67 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.085 -1.01 . . . . 0.0 109.177 179.727 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.529 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -156.63 91.05 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 0.0 109.393 179.75 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.534 ' C ' ' CD2' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -114.98 -15.02 11.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.245 -0.909 . . . . 0.0 109.295 -179.866 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CD2' ' C ' ' A' ' 12' ' ' MET . 1.5 m-85 55.79 30.66 16.14 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.875 . . . . 0.0 109.591 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' CG ' ' HB3' ' A' ' 12' ' ' MET . 3.3 p30 -101.86 -31.15 10.86 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.166 -0.959 . . . . 0.0 109.345 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -54.67 124.5 16.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.108 -0.995 . . . . 0.0 108.918 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.517 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -66.29 -30.87 71.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 121.354 0.597 . . . . 0.0 109.484 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -130.96 128.06 39.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.306 -0.872 . . . . 0.0 109.393 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.45 -151.75 34.91 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.38 -157.67 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -1.155 . . . . 0.0 109.621 -179.963 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 9' ' ' SER . 21.8 m -86.09 96.7 9.96 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 109.529 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 24.8 ttp180 -95.04 139.35 31.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.046 -1.034 . . . . 0.0 109.786 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.9 m 53.63 20.63 2.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -0.01 81.92 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.9 mtmm -118.52 164.91 14.59 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.139 -1.212 . . . . 0.0 109.882 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.21 164.91 23.27 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.299 -0.96 . . . . 0.0 108.782 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.514 0 O-C-N 119.829 -1.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' CYS . . . . . 0.591 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.42 0.629 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.557 ' HD2' ' N ' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -82.52 162.68 21.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.334 -0.854 . . . . 0.0 109.668 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.66 160.08 18.19 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.964 -1.655 . . . . 0.0 108.964 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -50.98 146.78 5.71 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.161 -1.199 . . . . 0.0 110.715 -179.401 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 71.51 -10.92 3.43 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 179.136 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.67 36.69 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.576 -1.543 . . . . 0.0 111.392 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 51.67 161.19 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.122 -0.987 . . . . 0.0 110.988 179.731 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' GLY . 24.4 p 179.05 -167.0 0.07 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.237 -0.914 . . . . 0.0 109.665 179.926 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.55 ' CB ' ' HB2' ' A' ' 12' ' ' MET . 0.3 OUTLIER -93.73 -161.8 0.88 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.426 -0.797 . . . . 0.0 109.234 -179.95 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' C ' HD12 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -91.74 -32.58 15.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.031 -1.043 . . . . 0.0 108.9 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' C ' ' A' ' 10' ' ' ARG . 1.2 mp -153.18 22.37 0.56 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.655 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' MET . . . . . 0.55 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 57.2 tpp -62.56 -17.74 60.61 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.3 m-85 63.27 49.03 3.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.471 -0.768 . . . . 0.0 110.344 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.75 -21.31 15.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 0.0 108.548 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.2 m -56.23 125.59 22.45 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 122.038 0.923 . . . . 0.0 109.264 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.591 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.1 -34.89 79.1 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.595 -179.759 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.77 HG23 ' O ' ' A' ' 17' ' ' THR . 9.7 t -154.56 89.89 1.29 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.35 -0.844 . . . . 0.0 109.346 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 151.85 -149.77 21.54 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 m -139.31 178.33 7.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.165 -1.197 . . . . 0.0 109.458 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.8 m -95.68 106.92 19.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.885 . . . . 0.0 109.729 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -118.06 135.84 53.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.484 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.26 28.81 4.45 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.323 -0.86 . . . . 0.0 109.681 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 80.02 -5.98 60.84 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 17.7 mttm -100.55 146.15 27.46 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.329 -1.1 . . . . 0.0 109.156 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -71.96 172.53 9.83 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.163 -0.961 . . . . 0.0 109.146 -179.832 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 26' ' ' NH2 . . . . . 0.449 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.911 -1.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.563 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.343 0.592 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -96.52 162.81 13.31 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.22 -0.925 . . . . 0.0 110.032 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -107.12 161.66 13.69 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HE2' ' NH1' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -43.56 159.81 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.178 -1.189 . . . . 0.0 109.819 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.03 12.13 10.58 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.88 16.52 1.15 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.074 -1.251 . . . . 0.0 110.625 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER 56.33 154.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.207 -0.933 . . . . 0.0 110.479 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.3 p 178.38 -147.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.577 -0.702 . . . . 0.0 109.504 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.435 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.9 OUTLIER -137.28 -142.52 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.163 -0.961 . . . . 0.0 109.396 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 24.6 tpt180 -112.26 100.59 8.93 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.059 -1.026 . . . . 0.0 109.155 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 83.96 77.28 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.419 0.628 . . . . 0.0 109.842 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.498 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 10.3 mmt -125.11 -40.39 2.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.87 . . . . 0.0 108.815 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.2 m-85 70.69 52.51 0.31 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.496 -0.753 . . . . 0.0 110.942 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.498 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -116.76 -23.85 7.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 108.621 178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 38.7 m -50.79 126.88 16.97 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.897 0.856 . . . . 0.0 109.605 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.563 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 4.1 t -58.22 -27.38 63.87 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.217 0.532 . . . . 0.0 109.638 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' A' ' 17' ' ' THR . 5.1 t -154.34 75.55 1.0 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.214 -0.929 . . . . 0.0 109.698 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 149.5 -167.16 29.71 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.6 m -127.37 -164.55 1.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -1.163 . . . . 0.0 109.715 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.7 m -79.43 116.34 19.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -114.79 115.79 27.57 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.284 -0.885 . . . . 0.0 109.457 179.458 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 66.04 33.94 7.29 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.433 -0.792 . . . . 0.0 110.12 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -11.38 59.87 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 21' ' ' ARG . 12.1 mttt -115.43 -175.55 2.73 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.099 -1.236 . . . . 0.0 109.371 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.463 179.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.539 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.21 0.529 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.522 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 1.2 mptm? -83.52 157.67 22.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 109.96 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -90.46 157.95 26.06 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -49.46 157.88 0.47 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.123 -1.222 . . . . 0.0 110.234 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.56 7.48 15.27 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.26 24.75 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.021 -1.281 . . . . 0.0 110.833 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.41 156.17 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.063 -1.023 . . . . 0.0 110.598 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 22.1 p 177.47 -165.57 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.548 -0.72 . . . . 0.0 109.745 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.437 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 8.4 t -101.53 -145.14 0.35 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.395 -0.816 . . . . 0.0 109.295 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -95.0 -24.22 17.03 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.099 -1.001 . . . . 0.0 109.7 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 1.014 HD23 ' OH ' ' A' ' 13' ' ' TYR . 2.7 mp -133.08 -105.91 0.25 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.9 OUTLIER 67.41 -58.16 0.43 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.895 -1.128 . . . . 0.0 109.846 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 1.014 ' OH ' HD23 ' A' ' 11' ' ' LEU . 42.8 m-85 71.02 45.49 0.51 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.434 -0.791 . . . . 0.0 109.725 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 3.3 m-20 -104.23 -20.76 13.68 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.111 -0.993 . . . . 0.0 109.231 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.5 m -47.42 127.11 10.64 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.814 . . . . 0.0 109.532 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.539 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 5.0 t -66.18 -13.15 59.78 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.395 0.617 . . . . 0.0 109.522 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.11 117.64 4.62 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.405 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.33 -153.12 24.96 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 31.7 t -137.09 -158.96 0.91 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.195 -1.18 . . . . 0.0 109.56 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 6.3 m -83.0 114.71 21.45 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.244 -0.91 . . . . 0.0 109.647 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 23.4 mtp180 -104.57 117.46 34.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.1 -1.0 . . . . 0.0 109.488 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.462 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 3.1 m 59.84 13.49 3.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.506 -0.747 . . . . 0.0 109.837 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.447 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 111.83 -24.12 15.64 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.2 mtmt -96.03 169.36 10.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -1.162 . . . . 0.0 109.661 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.421 0 O-C-N 121.186 -0.946 . . . . 0.0 109.49 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.568 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.269 0.557 . . . . 0.0 109.584 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 17.0 mmtt -96.83 170.5 9.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.456 -0.777 . . . . 0.0 109.661 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.09 151.97 18.01 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -51.85 155.22 1.81 Allowed 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.177 -1.19 . . . . 0.0 110.319 -179.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 67.13 0.25 9.41 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 27.25 0.33 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.82 -1.4 . . . . 0.0 110.993 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER 55.79 155.32 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.926 -1.109 . . . . 0.0 110.568 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.8 p 178.84 -175.17 0.2 Allowed 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.38 -0.825 . . . . 0.0 109.974 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 38.9 t -98.68 -142.01 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.364 -0.835 . . . . 0.0 109.233 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -92.34 -62.45 1.4 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.93 -1.106 . . . . 0.0 109.546 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.421 HD23 ' OH ' ' A' ' 13' ' ' TYR . 1.4 mp -123.11 58.87 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.28 -0.887 . . . . 0.0 109.591 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.0 mmm -81.93 -10.32 59.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.164 -0.96 . . . . 0.0 109.507 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.421 ' OH ' HD23 ' A' ' 11' ' ' LEU . 93.0 m-85 48.87 47.94 20.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 109.543 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 1.2 p30 -115.74 -19.55 10.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.1 m -62.38 124.8 21.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.224 -0.922 . . . . 0.0 109.933 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.568 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.73 -25.52 66.55 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.356 0.598 . . . . 0.0 109.707 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.14 112.33 4.34 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.162 -0.961 . . . . 0.0 109.558 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.42 -146.06 16.81 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.4 m -149.02 -169.11 3.29 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -1.119 . . . . 0.0 109.446 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.461 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.9 m -81.11 108.65 14.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.506 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 24' ' ' LYS . 18.2 ttt180 -104.57 121.81 44.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.244 -0.91 . . . . 0.0 109.677 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m 52.59 20.59 1.55 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.87 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.44 -21.35 39.49 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mttp -93.67 159.64 15.12 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.197 -1.178 . . . . 0.0 109.616 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.494 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.493 0 O-C-N 121.186 -0.946 . . . . 0.0 109.632 -179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.302 0.572 . . . . 0.0 109.552 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -84.36 158.96 20.97 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 109.54 -179.851 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.3 162.66 17.97 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HD2' HG21 ' A' ' 17' ' ' THR . 0.0 OUTLIER -55.64 149.47 14.04 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.079 -1.248 . . . . 0.0 109.667 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.84 -23.37 29.14 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.541 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.3 74.78 3.86 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.737 -0.861 . . . . 0.0 108.966 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -22.51 145.09 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.854 0.835 . . . . 0.0 112.081 -179.247 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.4 p -147.75 -166.49 2.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 110.112 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.4 t -93.92 -122.87 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.347 -0.846 . . . . 0.0 109.27 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.487 ' HG3' HD12 ' A' ' 11' ' ' LEU . 0.9 OUTLIER -118.75 -61.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.719 -1.238 . . . . 0.0 109.756 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.643 HD23 ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -123.2 80.88 1.82 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.793 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.7 mmm -114.27 -25.33 8.5 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.187 -0.946 . . . . 0.0 109.156 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.643 ' OH ' HD23 ' A' ' 11' ' ' LEU . 29.1 m-85 70.29 38.13 1.48 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.357 -0.84 . . . . 0.0 109.656 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB2' ' HE2' ' A' ' 2' ' ' LYS . 1.1 p30 -103.33 -36.24 8.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.222 -0.924 . . . . 0.0 109.218 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.3 m -49.53 125.72 11.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.0 109.409 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -66.65 -15.06 63.21 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 121.312 0.577 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.474 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 5.4 t -99.42 -144.57 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 0.0 109.125 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.474 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -50.42 -99.43 0.01 OUTLIER Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.413 ' O ' ' C ' ' A' ' 20' ' ' CYS . 21.3 p -151.54 176.07 11.69 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.078 -1.248 . . . . 0.0 109.432 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.4 m -44.28 129.1 6.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 109.303 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 1.2 ttt180 -131.47 140.93 49.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.033 -1.042 . . . . 0.0 109.491 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m 47.43 24.64 0.5 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.178 -0.951 . . . . 0.0 109.271 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.34 -23.68 17.5 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -105.57 165.61 11.03 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -1.172 . . . . 0.0 109.914 -179.774 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.491 1.588 0 O-C-N 121.148 -0.97 . . . . 0.0 109.467 -179.946 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.53 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 25.4 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.302 0.572 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmtm -113.21 -167.11 1.15 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.33 -0.857 . . . . 0.0 110.77 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.35 -178.01 15.19 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.93 151.23 15.09 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.084 -1.244 . . . . 0.0 109.59 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.93 -29.79 8.84 Favored Glycine 0 N--CA 1.485 1.959 0 N-CA-C 107.772 -2.131 . . . . 0.0 107.772 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.42 73.89 0.36 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.59 150.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.311 0.577 . . . . 0.0 110.371 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 23' ' ' GLY . 29.8 p -159.51 -163.57 1.2 Allowed 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.202 -0.936 . . . . 0.0 109.789 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.459 ' CB ' ' HG3' ' A' ' 12' ' ' MET . 7.7 t -94.99 -125.75 0.12 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.335 -0.853 . . . . 0.0 109.196 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -122.46 -31.38 3.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.748 -1.22 . . . . 0.0 109.748 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.37 19.72 3.99 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.459 ' HG3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -59.12 -25.42 63.82 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.959 -1.088 . . . . 0.0 108.853 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 53.28 80.57 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.87 . . . . 0.0 109.487 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' A' ' 15' ' ' CYS . 4.4 m-20 -136.35 -38.25 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.519 -0.738 . . . . 0.0 109.286 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 14' ' ' ASP . 7.6 m -43.55 124.74 3.67 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.085 0.945 . . . . 0.0 109.535 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.53 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -67.15 -24.15 65.87 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.416 0.627 . . . . 0.0 109.432 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 p -130.62 94.27 3.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.335 -0.853 . . . . 0.0 109.21 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.68 -163.69 15.43 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' CYS . 51.4 p -129.77 171.14 12.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.257 -1.143 . . . . 0.0 109.532 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.1 m -43.61 130.31 5.32 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.203 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -121.2 129.35 53.16 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.158 -0.964 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 43.7 m 48.19 22.62 0.44 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.36 -0.837 . . . . 0.0 109.586 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 102.33 -36.14 4.48 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.3 mttt -95.88 160.16 14.61 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.091 -1.241 . . . . 0.0 109.59 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.594 0 O-C-N 121.055 -1.028 . . . . 0.0 109.326 179.903 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.485 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.256 0.551 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.513 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -75.81 158.45 32.16 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.216 -0.927 . . . . 0.0 110.019 -179.724 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.32 158.42 19.95 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 3' ' ' GLY . 0.0 OUTLIER -45.3 156.53 0.11 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.059 -1.26 . . . . 0.0 110.136 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 55.62 11.0 3.57 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -80.92 22.49 0.61 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.808 -1.407 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 56.41 151.33 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.07 -1.019 . . . . 0.0 110.713 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.9 p 177.73 -151.06 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 109.881 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 68.2 m -115.27 -123.48 0.29 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.375 -0.828 . . . . 0.0 109.509 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 21.7 mmm180 -118.17 -41.24 2.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.777 -1.202 . . . . 0.0 109.798 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.58 70.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.194 -0.941 . . . . 0.0 109.623 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.2 mtm -102.56 -7.63 21.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 62.68 52.6 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.61 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -126.81 -9.07 6.09 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.0 109.811 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 83.4 m -72.23 119.65 16.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 4.2 t -68.82 -13.42 62.39 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.577 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 23.2 p -122.44 2.93 9.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.881 -1.137 . . . . 0.0 111.507 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.495 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 169.01 -124.0 1.13 Allowed Glycine 0 N--CA 1.494 2.52 0 C-N-CA 118.927 -1.606 . . . . 0.0 110.491 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -132.83 -161.82 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.434 -1.039 . . . . 0.0 109.714 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.1 m -86.07 128.39 34.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.413 -0.804 . . . . 0.0 110.262 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.0 141.75 50.71 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.326 -0.859 . . . . 0.0 108.819 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.0 t 47.72 23.55 0.44 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.307 -0.87 . . . . 0.0 109.496 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.52 -33.23 5.44 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.6 mttp -96.15 171.66 8.46 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.109 -1.23 . . . . 0.0 109.806 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 0.0 109.558 -179.991 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.542 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.326 0.584 . . . . 0.0 109.597 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -82.33 157.78 23.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 109.893 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.51 162.0 30.24 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.522 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.57 156.26 3.57 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.028 -1.278 . . . . 0.0 109.819 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 64.79 6.22 22.66 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.0 26.68 0.33 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.912 -1.346 . . . . 0.0 110.7 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.43 155.55 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.283 0 O-C-N 120.979 -1.076 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 16.5 p -179.2 -158.67 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.38 -0.825 . . . . 0.0 109.745 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 3.5 t -106.96 -102.37 0.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.648 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.461 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.0 ttt180 -140.23 -44.36 0.42 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.075 -1.016 . . . . 0.0 109.857 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.22 39.01 1.92 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.846 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.503 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 7.9 mmt -78.78 -22.48 46.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.074 -1.016 . . . . 0.0 109.156 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 38.9 m-85 60.85 73.14 0.49 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -0.871 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' HB2' ' A' ' 12' ' ' MET . 0.0 OUTLIER -134.94 9.58 3.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.322 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 18.5 m -86.13 125.41 33.47 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.178 -0.951 . . . . 0.0 109.794 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.542 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -66.7 -23.89 66.18 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.717 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -153.18 72.04 0.93 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.16 -0.963 . . . . 0.0 109.667 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 150.99 -167.96 30.63 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.3 t -138.55 161.32 37.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -1.117 . . . . 0.0 109.299 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.3 m -52.08 127.27 21.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.324 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER -139.12 121.75 16.32 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.164 -0.96 . . . . 0.0 109.816 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.55 10.29 4.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 109.908 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.78 -2.44 33.97 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -121.99 174.48 6.88 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.045 -1.268 . . . . 0.0 109.64 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.62 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.525 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.6 mmtt -107.48 -166.75 1.18 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.247 -0.908 . . . . 0.0 109.946 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.46 160.54 25.15 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.4 pttp -53.55 152.0 5.37 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.959 -1.318 . . . . 0.0 109.451 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.03 -31.5 7.26 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 107.61 -2.196 . . . . 0.0 107.61 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.33 80.21 3.84 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.9 pttt -28.44 149.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.443 0.639 . . . . 0.0 110.739 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -150.98 -162.32 1.53 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.099 -1.001 . . . . 0.0 109.904 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.51 ' HB2' ' CG ' ' A' ' 12' ' ' MET . 73.2 m -94.07 -101.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.209 -0.932 . . . . 0.0 109.703 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -167.48 115.65 0.79 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.509 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 76.02 16.06 2.36 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.322 -0.861 . . . . 0.0 109.612 179.813 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.51 ' CG ' ' HB2' ' A' ' 9' ' ' SER . 36.4 mmt -74.17 -9.31 58.49 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.123 -0.986 . . . . 0.0 109.265 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 12' ' ' MET . 19.2 m-85 42.52 57.05 3.58 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -0.852 . . . . 0.0 109.549 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -116.55 -22.08 8.87 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.28 -0.887 . . . . 0.0 109.24 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.8 m -61.76 124.25 20.21 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.192 0.996 . . . . 0.0 109.837 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.525 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -66.9 -36.94 83.41 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.72 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 t -128.9 72.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.337 -0.852 . . . . 0.0 109.408 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.63 -158.3 26.54 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 p -148.63 168.16 23.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.101 . . . . 0.0 109.376 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 8.6 m -57.65 92.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.345 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 24' ' ' LYS . 8.8 ttm180 -103.7 135.23 45.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.325 -0.859 . . . . 0.0 109.403 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 t 58.6 22.13 9.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.247 -0.908 . . . . 0.0 109.379 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.13 -14.77 61.3 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 32.3 mttm -107.15 172.48 6.8 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.12 -1.223 . . . . 0.0 109.518 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.46 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.497 0 O-C-N 121.096 -1.003 . . . . 0.0 109.217 179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.576 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.279 0.561 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 15.4 mmtm -122.52 -167.65 1.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 109.838 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.431 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -143.72 161.88 27.74 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -41.1 148.52 0.11 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.365 -1.08 . . . . 0.0 110.107 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.97 -34.18 5.09 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 107.963 -2.055 . . . . 0.0 107.963 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.62 80.57 4.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.591 -0.946 . . . . 0.0 108.785 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -33.09 155.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.248 0.547 . . . . 0.0 110.39 -179.567 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -142.48 -145.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.032 -1.043 . . . . 0.0 109.904 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.541 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -111.95 7.16 19.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.816 -1.178 . . . . 0.0 110.351 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.547 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 0.0 OUTLIER 82.95 -13.62 0.8 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.638 -0.664 . . . . 0.0 109.772 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.06 22.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.044 -1.035 . . . . 0.0 109.503 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -83.25 -21.13 33.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.183 -0.948 . . . . 0.0 109.049 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.7 m-85 61.95 66.95 0.78 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.888 . . . . 0.0 109.837 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 15.9 p-10 -118.3 -20.25 8.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.189 -0.945 . . . . 0.0 109.257 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -60.68 127.38 31.39 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.919 0.866 . . . . 0.0 109.22 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.576 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -61.87 -41.1 97.45 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -131.6 120.75 23.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.409 -0.807 . . . . 0.0 108.977 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.18 -152.51 17.05 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.299 -1.52 . . . . 0.0 109.299 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 m -150.92 161.04 43.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.086 -1.244 . . . . 0.0 109.711 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.547 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -48.51 117.56 2.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 0.0 109.262 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.8 ttm180 -113.65 136.32 52.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.043 -1.036 . . . . 0.0 109.333 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 49.26 27.32 1.82 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 109.437 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.36 -22.22 21.06 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 7.1 mtmt -100.35 168.42 9.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.172 -1.193 . . . . 0.0 109.651 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.528 0 O-C-N 120.936 -1.102 . . . . 0.0 108.829 179.465 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.395 0.617 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -71.11 159.67 34.28 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.318 -0.864 . . . . 0.0 109.603 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.66 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -105.15 168.96 16.02 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -55.73 163.12 1.47 Allowed 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.086 -1.244 . . . . 0.0 109.655 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 43.84 25.1 0.56 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.59 21.86 0.49 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -1.126 . . . . 0.0 111.119 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.494 ' C ' ' O ' ' A' ' 6' ' ' ALA . 12.1 pttm 34.72 43.1 0.09 Allowed 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.992 0.901 . . . . 0.0 109.624 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.64 ' N ' ' O ' ' A' ' 23' ' ' GLY . 20.7 p -68.52 -148.95 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 CA-C-O 121.44 0.638 . . . . 0.0 109.923 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 0.6 OUTLIER -106.53 -140.45 0.37 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.575 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.483 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ttp180 -132.98 116.48 16.47 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.111 -0.993 . . . . 0.0 108.889 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER 63.42 45.57 4.78 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.723 -0.61 . . . . 0.0 109.854 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.483 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 1.4 mmm -100.06 -5.37 28.11 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.379 -0.826 . . . . 0.0 109.235 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 55.07 53.4 10.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.358 -0.839 . . . . 0.0 109.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.497 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 56.2 m-20 -124.12 -28.89 3.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.268 -0.895 . . . . 0.0 109.715 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 89.2 m -44.65 125.3 4.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 109.367 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -64.38 -28.69 69.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.41 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.455 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.3 p -153.66 31.8 0.46 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.024 -1.047 . . . . 0.0 109.73 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -154.9 -159.62 9.39 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' N ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -133.97 122.91 23.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -1.074 . . . . 0.0 109.219 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' SER . 1.6 m -43.01 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.53 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -113.32 137.82 50.94 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.182 -0.948 . . . . 0.0 109.268 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.47 24.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.042 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.64 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 87.0 -21.47 19.75 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 23.7 mttt -93.09 134.07 35.62 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.839 -1.389 . . . . 0.0 109.117 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.297 -1.71 0 O-C-N 121.568 -0.708 . . . . 0.0 109.526 -179.721 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.556 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.318 0.58 . . . . 0.0 109.489 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -88.79 166.25 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.266 -0.896 . . . . 0.0 109.701 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -118.67 153.02 17.17 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -42.43 147.83 0.25 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -1.104 . . . . 0.0 110.02 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.97 -29.34 8.79 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.86 75.17 0.46 Allowed 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.541 -0.976 . . . . 0.0 108.529 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.26 149.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.614 0.721 . . . . 0.0 110.586 -179.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -152.11 -156.96 0.75 Allowed 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.213 -0.93 . . . . 0.0 109.799 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.481 ' HB3' ' HG2' ' A' ' 12' ' ' MET . 10.7 t -93.42 -110.86 0.11 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.289 -0.882 . . . . 0.0 109.52 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' OG ' ' A' ' 9' ' ' SER . 52.4 ttt180 -135.35 -45.7 0.69 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.775 -1.203 . . . . 0.0 110.024 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.16 45.57 2.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.006 -1.059 . . . . 0.0 109.951 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' HB3' ' A' ' 9' ' ' SER . 14.5 mmt -80.36 -36.98 33.3 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.069 -1.02 . . . . 0.0 109.058 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.416 ' HB2' ' O ' ' A' ' 12' ' ' MET . 5.0 m-30 60.16 35.24 21.13 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.43 -0.794 . . . . 0.0 109.989 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -94.96 -12.15 27.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.123 -0.985 . . . . 0.0 108.962 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.2 m -57.61 133.64 55.47 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.105 0.955 . . . . 0.0 109.607 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.556 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.0 t -66.05 -30.38 70.9 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.257 -179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.455 ' O ' HG23 ' A' ' 17' ' ' THR . 1.7 t -142.32 81.0 1.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.952 -1.092 . . . . 0.0 109.952 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.48 -160.0 25.0 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.24 164.58 29.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.409 -1.054 . . . . 0.0 109.388 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 m -50.5 99.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -0.937 . . . . 0.0 109.521 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -112.98 145.93 39.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.139 -0.976 . . . . 0.0 109.746 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.7 t 55.31 26.33 8.49 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.443 -0.786 . . . . 0.0 109.519 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.67 -6.97 59.88 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -121.03 179.36 4.4 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.485 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.299 -1.593 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.954 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 4.1 p . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.291 0.567 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.6 mmtp -106.94 -176.77 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.21 -0.931 . . . . 0.0 110.107 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.54 163.91 12.66 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -50.25 156.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.948 -1.324 . . . . 0.0 109.19 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.66 -32.08 6.33 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -74.04 77.23 1.71 Allowed 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 178.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -30.71 150.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 121.338 0.589 . . . . 0.0 110.338 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -146.79 -166.09 2.41 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.986 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -94.31 -102.63 0.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.327 -0.858 . . . . 0.0 109.611 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.1 ttm180 -148.31 112.92 5.35 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.158 -0.964 . . . . 0.0 109.174 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.5 mt 64.01 28.25 14.34 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.445 -0.784 . . . . 0.0 109.453 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 2.5 mmt -58.74 -21.71 56.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.315 -0.866 . . . . 0.0 109.447 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' MET . 40.5 m-85 59.27 33.96 22.81 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.739 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -110.41 -30.48 7.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.253 -0.905 . . . . 0.0 109.241 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -54.37 124.43 15.95 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 122.214 1.007 . . . . 0.0 109.042 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.7 t -66.8 -25.09 66.29 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.759 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 18' ' ' GLY . 54.5 p -90.73 -128.84 0.09 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.237 -0.915 . . . . 0.0 109.089 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.9 -119.33 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.0 p -146.52 175.45 10.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.126 -1.22 . . . . 0.0 109.456 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.3 m -45.39 103.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.236 -0.915 . . . . 0.0 109.462 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.11 133.33 50.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 109.334 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.27 22.86 2.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.136 -0.978 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.43 -19.52 46.83 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.1 mtpt -101.22 159.46 15.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -1.162 . . . . 0.0 109.384 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 O-C-N 121.077 -1.014 . . . . 0.0 109.113 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.574 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.222 0.534 . . . . 0.0 109.759 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 27.0 mmtm -81.52 -171.73 3.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.301 -0.875 . . . . 0.0 109.618 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.709 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -122.79 161.92 16.81 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -58.75 162.67 3.83 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.295 -1.121 . . . . 0.0 109.777 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 47.79 24.14 2.8 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.709 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.62 21.87 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.321 -1.105 . . . . 0.0 111.479 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.515 ' C ' ' O ' ' A' ' 6' ' ' ALA . 19.9 ptmt 30.79 44.65 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 121.887 0.851 . . . . 0.0 110.11 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.61 ' N ' ' O ' ' A' ' 23' ' ' GLY . 29.7 p -70.63 -153.64 0.02 OUTLIER 'General case' 0 C--N 1.29 -2.012 0 O-C-N 121.815 -0.553 . . . . 0.0 109.869 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.451 ' O ' ' HA2' ' A' ' 23' ' ' GLY . 1.4 t -103.26 -140.93 0.36 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 109.868 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.544 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.6 OUTLIER -128.43 108.43 10.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.067 -1.021 . . . . 0.0 109.148 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.544 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 80.2 53.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.555 -0.716 . . . . 0.0 109.52 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.8 mmm -103.27 -16.44 15.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.944 . . . . 0.0 109.289 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 57.09 50.7 11.51 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' C ' ' A' ' 15' ' ' CYS . 1.0 OUTLIER -124.13 -27.24 3.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.717 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.48 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 64.8 m -45.47 123.08 3.92 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 122.122 0.963 . . . . 0.0 109.763 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.574 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.7 t -67.28 -9.95 45.96 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.077 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.8 p -130.2 -5.13 4.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.716 -1.24 . . . . 0.0 111.006 -178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.48 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . -170.24 -127.84 0.97 Allowed Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.377 -1.392 . . . . 0.0 110.023 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.422 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 33.0 t -140.58 162.68 34.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.274 -1.133 . . . . 0.0 109.519 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.3 m -51.11 126.56 16.82 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.91 . . . . 0.0 109.636 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.13 123.35 40.11 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.165 -0.959 . . . . 0.0 109.061 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.75 27.45 4.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 108.765 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.61 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 91.06 -32.7 5.02 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 1.4 mttm -92.73 135.85 33.74 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.366 -1.079 . . . . 0.0 109.277 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--N 1.299 -1.618 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.482 -179.686 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.557 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.479 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 2.5 mptt -81.84 161.7 23.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.324 -0.86 . . . . 0.0 110.115 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -109.19 161.68 13.03 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 108.812 -1.715 . . . . 0.0 108.812 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -41.37 150.47 0.09 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.289 -1.124 . . . . 0.0 109.926 -179.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 96.22 -31.57 7.26 Favored Glycine 0 N--CA 1.487 2.069 0 N-CA-C 107.881 -2.087 . . . . 0.0 107.881 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.11 75.89 0.34 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -28.93 150.09 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.399 0.619 . . . . 0.0 110.475 -179.418 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.9 p -157.16 -161.67 1.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.136 -0.978 . . . . 0.0 109.735 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 86.9 p -98.84 -143.72 0.32 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.296 -0.877 . . . . 0.0 109.425 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -30.22 18.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.0 109.445 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.3 mt -153.84 44.07 0.58 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.177 -0.952 . . . . 0.0 109.956 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -53.31 -23.68 9.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.065 -1.022 . . . . 0.0 109.162 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 12' ' ' MET . 10.7 m-85 63.67 36.1 11.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.622 179.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.03 -25.47 5.77 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.087 -1.008 . . . . 0.0 109.304 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.8 m -52.93 126.21 19.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.987 . . . . 0.0 109.157 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.557 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.87 -28.04 68.01 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.349 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.98 135.65 47.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.066 -1.021 . . . . 0.0 109.719 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.26 -176.29 3.89 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.26 -171.83 1.94 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.28 -1.129 . . . . 0.0 109.47 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 9' ' ' SER . 9.0 m -61.37 103.34 0.3 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.303 -0.873 . . . . 0.0 109.446 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . 28.6 tpt180 -97.81 135.72 39.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 t 51.5 32.52 8.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.278 -0.889 . . . . 0.0 109.718 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.27 -9.7 46.59 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -110.94 172.02 7.12 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.015 -1.286 . . . . 0.0 109.552 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m . . . . . 0 C--N 1.3 -1.562 0 C-N-CA 119.46 -0.896 . . . . 0.0 108.839 179.565 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 7.5 p . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 121.303 0.573 . . . . 0.0 109.535 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 16.5 mmtt -99.04 168.96 9.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 109.91 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.45 169.43 20.47 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.02 156.97 13.68 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.177 -1.19 . . . . 0.0 110.102 -179.548 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 70.9 -0.87 26.94 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.06 22.03 0.54 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.971 -1.311 . . . . 0.0 110.963 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.88 154.17 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.941 -1.099 . . . . 0.0 110.46 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 30.9 p 175.14 173.95 0.23 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.482 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -93.33 -163.36 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.1 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.454 ' CG ' HH11 ' A' ' 10' ' ' ARG . 0.0 OUTLIER -60.61 -61.44 2.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.031 -1.043 . . . . 0.0 109.519 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' CZ ' ' A' ' 13' ' ' TYR . 2.6 mp -138.04 72.63 1.42 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.274 -0.891 . . . . 0.0 109.614 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.493 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -86.57 -14.9 41.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.105 -0.997 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.493 ' CD2' ' O ' ' A' ' 12' ' ' MET . 3.9 m-85 69.29 54.73 0.41 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -130.23 -11.19 4.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.136 -0.977 . . . . 0.0 110.134 -179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.1 m -73.15 124.62 25.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.118 -0.989 . . . . 0.0 109.882 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -67.09 -27.4 67.32 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 121.369 0.604 . . . . 0.0 109.42 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' THR . 4.5 t -150.91 126.85 10.39 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.261 -0.899 . . . . 0.0 109.281 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.26 -166.93 28.61 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.07 -167.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -1.147 . . . . 0.0 109.673 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.482 ' SG ' ' O ' ' A' ' 9' ' ' SER . 6.9 m -85.43 117.38 24.31 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.361 -0.837 . . . . 0.0 109.728 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 24' ' ' LYS . 4.2 ttt180 -122.67 131.01 53.61 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.167 -0.958 . . . . 0.0 109.268 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 57.41 28.18 15.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.294 -0.879 . . . . 0.0 109.208 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.93 7.63 88.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 10.5 mtpt -120.26 162.34 19.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.191 -1.182 . . . . 0.0 110.0 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.462 -0.774 . . . . 0.0 109.301 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -111.15 168.62 9.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.86 . . . . 0.0 109.976 -179.629 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.2 165.17 25.06 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.424 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.8 153.55 24.17 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.094 -1.239 . . . . 0.0 110.109 -179.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.71 2.73 12.47 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.12 28.64 0.29 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.825 -1.397 . . . . 0.0 110.902 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.56 157.04 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.893 -1.13 . . . . 0.0 110.358 -179.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.523 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.2 p 179.23 -174.06 0.2 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.432 -0.793 . . . . 0.0 109.961 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.2 t -94.48 -118.52 0.1 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.248 -0.907 . . . . 0.0 109.404 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -119.86 -76.65 0.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.915 -1.116 . . . . 0.0 109.679 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.573 HD23 ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -111.76 28.51 8.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.054 -1.029 . . . . 0.0 109.756 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mmt -59.09 -22.65 61.15 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.295 -0.878 . . . . 0.0 109.204 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.0 m-85 62.76 56.61 1.9 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.405 -0.81 . . . . 0.0 109.845 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.428 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 75.2 m-20 -114.38 -37.94 4.21 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 28.4 m -44.1 125.03 4.2 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 109.544 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.2 t -66.81 -10.09 44.1 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.936 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 18' ' ' GLY . 17.6 p -146.21 -106.65 0.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.891 . . . . 0.0 109.556 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -43.82 167.16 0.02 OUTLIER Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 p -94.94 -168.85 1.88 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.204 -1.174 . . . . 0.0 109.614 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.0 m -81.92 117.52 22.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.315 -0.865 . . . . 0.0 109.792 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.27 113.44 26.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.129 -0.982 . . . . 0.0 109.324 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 16.35 2.01 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.686 -0.634 . . . . 0.0 109.804 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 112.18 -19.11 22.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.1 mtpp -93.48 151.92 19.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.099 -1.236 . . . . 0.0 109.637 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 109.55 179.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.57 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.5 p . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.354 0.597 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HA ' ' CE ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -90.48 -169.4 2.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.534 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -121.18 153.2 16.67 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 6' ' ' ALA . 1.2 ttmt -48.84 152.77 0.95 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.935 -1.332 . . . . 0.0 109.958 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 45.95 18.03 0.23 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -81.36 26.17 0.47 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.318 . . . . 0.0 110.715 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.77 157.9 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.042 -1.036 . . . . 0.0 110.284 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 15.5 p -179.48 -157.64 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.352 -0.842 . . . . 0.0 110.115 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.85 -89.27 0.58 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.402 -0.811 . . . . 0.0 109.739 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.505 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -141.41 -118.72 0.11 Allowed 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.421 -0.799 . . . . 0.0 109.861 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.8 mm? -79.01 52.9 1.33 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.737 -1.227 . . . . 0.0 110.02 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.7 mmm -75.78 -13.14 60.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.134 -0.979 . . . . 0.0 109.003 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 53.32 47.02 25.17 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.393 -0.817 . . . . 0.0 109.968 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' CYS . 12.7 t0 -110.87 -30.04 7.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 109.235 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 19' ' ' SER . 74.4 m -43.58 124.19 3.44 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.093 0.949 . . . . 0.0 109.404 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.57 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.77 -22.99 66.02 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 17' ' ' THR . 10.4 t -153.96 54.5 0.71 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.967 . . . . 0.0 109.746 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 167.39 -147.51 11.86 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.463 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 28.3 t -146.26 -162.8 1.6 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.337 -1.096 . . . . 0.0 109.526 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.0 m -94.43 105.3 17.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.744 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.7 OUTLIER -119.38 131.89 55.75 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.203 -0.935 . . . . 0.0 109.061 179.665 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.407 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 22.7 t 62.5 14.82 7.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.323 -0.861 . . . . 0.0 109.322 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.441 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.16 -23.87 34.29 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.2 mtmm -100.55 170.16 8.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.21 -1.171 . . . . 0.0 109.934 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.549 -179.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.562 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.388 0.613 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.51 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 2.7 mptp? -84.84 -174.97 5.56 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.0 109.843 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.21 169.56 14.91 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.495 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.7 mtpt -57.21 150.75 17.03 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.103 -1.233 . . . . 0.0 109.959 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.36 -4.87 38.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.507 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.9 25.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.245 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.62 157.59 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 O-C-N 120.941 -1.099 . . . . 0.0 110.884 179.835 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.0 p -179.9 -157.47 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.438 -0.789 . . . . 0.0 109.789 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.511 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 0.3 OUTLIER -116.78 -82.79 0.63 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.924 . . . . 0.0 109.548 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.527 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -156.96 -66.65 0.1 Allowed 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.428 -0.795 . . . . 0.0 109.902 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.428 HD12 ' HB3' ' A' ' 10' ' ' ARG . 2.3 mp -107.51 24.58 12.67 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.094 -1.004 . . . . 0.0 109.955 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.511 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 0.0 OUTLIER -57.25 -26.64 61.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.171 -0.956 . . . . 0.0 108.9 179.536 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 49.32 33.44 5.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.495 -0.753 . . . . 0.0 110.073 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.52 -24.56 16.01 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.122 -0.986 . . . . 0.0 108.924 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 m -51.84 125.07 14.1 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 122.19 0.995 . . . . 0.0 109.568 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.562 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.4 t -67.0 -12.56 60.21 Favored 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.6 p -106.07 -122.23 0.23 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.219 -0.926 . . . . 0.0 109.745 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.21 -129.58 0.08 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -120.85 -171.68 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.276 -1.132 . . . . 0.0 109.7 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.8 m -63.22 155.24 28.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.684 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.413 ' N ' ' O ' ' A' ' 24' ' ' LYS . 60.3 ttt180 -146.08 124.46 12.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.333 -0.855 . . . . 0.0 109.334 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.1 m 52.1 24.61 2.79 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.846 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.452 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.13 -24.24 32.69 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.3 mttt -93.95 177.39 6.0 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.048 -1.266 . . . . 0.0 109.544 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.579 -179.972 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.294 0.568 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -113.68 168.53 9.69 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.274 -0.891 . . . . 0.0 109.552 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.41 154.35 17.14 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -55.33 155.42 5.13 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.967 -1.313 . . . . 0.0 109.748 -179.765 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.5 -13.32 11.86 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.524 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.16 37.74 0.33 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.82 -1.4 . . . . 0.0 111.097 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 mttp 50.57 167.94 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.5 p 179.17 -175.54 0.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.076 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.484 ' O ' ' HD3' ' A' ' 10' ' ' ARG . 2.9 m -105.26 -103.74 0.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.355 -0.84 . . . . 0.0 109.514 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 9' ' ' SER . 3.2 mmt180 -128.26 -106.99 0.3 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.038 -1.039 . . . . 0.0 109.592 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.55 70.01 3.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.736 -1.228 . . . . 0.0 109.606 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 19.2 mmt -97.66 -31.71 12.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -0.906 . . . . 0.0 109.547 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.513 ' CB ' ' O ' ' A' ' 12' ' ' MET . 3.1 m-85 77.56 40.91 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.5 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.468 ' OD2' ' HB2' ' A' ' 12' ' ' MET . 2.9 m-20 -96.48 -25.47 15.65 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.133 -0.979 . . . . 0.0 109.236 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 33.2 m -55.54 127.03 27.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.218 -0.926 . . . . 0.0 109.776 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -65.76 -30.58 71.26 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.542 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.412 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.2 p -150.55 37.49 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.003 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -164.94 -155.52 8.52 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 p -147.93 167.91 23.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.35 -1.088 . . . . 0.0 109.047 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 1.6 m -56.03 125.06 19.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.105 -0.997 . . . . 0.0 109.215 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -121.2 100.22 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.173 -0.954 . . . . 0.0 109.689 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.98 2.21 3.48 Favored 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.84 -0.538 . . . . 0.0 110.316 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.458 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 137.74 -30.24 2.59 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 119.587 -1.292 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -102.73 177.31 4.89 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.995 -1.297 . . . . 0.0 109.998 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.493 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.671 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.421 179.637 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.396 0.617 . . . . 0.0 109.609 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -104.61 165.09 11.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.901 . . . . 0.0 109.759 -179.775 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.43 165.0 16.66 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 8.3 mtpp -59.96 150.08 30.01 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.123 -1.222 . . . . 0.0 110.389 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 57.14 9.05 3.76 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.77 27.68 0.37 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.727 -1.454 . . . . 0.0 110.647 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.72 154.46 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 O-C-N 121.039 -1.038 . . . . 0.0 110.894 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 14.9 p -178.71 -158.19 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.8 p -98.0 -131.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.366 -0.834 . . . . 0.0 109.496 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 11' ' ' LEU . 65.9 mtm180 -134.63 -0.5 2.88 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.786 -1.196 . . . . 0.0 110.382 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -174.44 35.12 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.785 -1.197 . . . . 0.0 110.566 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.445 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -91.22 -19.57 22.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.17 -0.956 . . . . 0.0 108.793 179.25 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.1 m-85 61.61 57.92 2.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.468 -0.77 . . . . 0.0 110.253 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.445 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 0.8 OUTLIER -106.82 -11.05 15.86 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.224 -0.922 . . . . 0.0 109.014 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 72.8 m -57.82 125.76 24.45 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 122.05 0.929 . . . . 0.0 110.026 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.9 t -57.96 -33.01 68.39 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.967 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -143.27 -22.03 0.62 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.06 -1.025 . . . . 0.0 111.276 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -101.69 -148.33 21.2 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.432 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 66.1 p -140.25 -174.17 3.87 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.426 -1.044 . . . . 0.0 108.994 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 m -91.78 96.18 10.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.02 -1.05 . . . . 0.0 109.395 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 143.78 50.67 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 65.2 28.61 12.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.284 -0.885 . . . . 0.0 109.578 -180.0 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.99 11.65 67.04 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.2 mtmm -140.83 173.3 11.62 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 C--N 1.295 -1.769 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.101 179.806 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.54 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.269 0.556 . . . . 0.0 109.515 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 11.7 mmtt -95.11 -172.4 2.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.387 -0.821 . . . . 0.0 109.962 -179.51 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.439 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -139.73 157.54 25.28 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -43.65 152.05 0.17 Allowed 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.294 -1.121 . . . . 0.0 109.699 -179.856 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.18 -30.27 6.45 Favored Glycine 0 N--CA 1.485 1.955 0 N-CA-C 108.245 -1.942 . . . . 0.0 108.245 -179.055 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.07 76.19 3.63 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.459 -1.024 . . . . 0.0 108.533 179.248 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.47 153.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.177 0.513 . . . . 0.0 110.222 -179.652 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 24.6 p -144.28 -160.48 1.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.071 -1.018 . . . . 0.0 109.518 -179.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.02 -83.7 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.127 -0.983 . . . . 0.0 109.459 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.464 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -175.18 105.82 0.09 Allowed 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.469 -0.77 . . . . 0.0 109.64 -179.975 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 70.06 44.33 0.8 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.328 -0.858 . . . . 0.0 109.899 179.807 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.464 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 13.5 mmm -90.52 -15.61 30.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 109.0 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 55.62 59.29 3.94 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.726 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 5.1 m-20 -124.21 -30.18 3.48 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.194 -0.941 . . . . 0.0 109.523 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 12.2 m -49.56 125.0 10.46 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 122.066 0.936 . . . . 0.0 109.348 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.54 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.5 t -66.77 -14.65 62.85 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.125 -179.558 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 t -119.71 31.73 6.41 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.085 -1.009 . . . . 0.0 109.862 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 141.98 -150.89 22.42 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 179.771 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 20' ' ' CYS . 7.5 p -124.16 175.88 6.74 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.364 -1.08 . . . . 0.0 109.288 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 19' ' ' SER . 16.8 m -44.58 147.11 0.63 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.205 -0.934 . . . . 0.0 109.62 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.1 ttt180 -123.6 100.8 6.98 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -0.822 . . . . 0.0 108.841 179.377 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 p 59.89 12.89 3.29 Favored 'General case' 0 C--N 1.292 -1.903 0 O-C-N 121.801 -0.562 . . . . 0.0 110.045 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.46 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 127.92 -37.71 2.25 Favored Glycine 0 N--CA 1.493 2.457 0 C-N-CA 119.803 -1.189 . . . . 0.0 110.241 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -103.07 162.59 12.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.1 -1.235 . . . . 0.0 109.86 -179.509 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.521 0 O-C-N 120.823 -1.173 . . . . 0.0 109.012 179.799 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.55 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -116.36 -167.49 1.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.195 -0.94 . . . . 0.0 110.332 -179.015 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.02 161.46 25.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.479 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -59.53 152.78 21.12 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.421 . . . . 0.0 109.37 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.58 -34.73 4.68 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 107.311 -2.316 . . . . 0.0 107.311 -178.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.39 83.33 3.83 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.67 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.57 152.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.361 0.6 . . . . 0.0 110.527 -179.549 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -156.95 -156.18 0.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.02 -1.05 . . . . 0.0 109.848 -179.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -93.73 -137.29 0.2 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 -179.754 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 2.6 mtp180 -134.77 112.79 11.02 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 120.923 -1.11 . . . . 0.0 109.191 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.6 mp 63.64 65.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.618 -0.676 . . . . 0.0 109.564 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.466 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -116.68 -16.62 10.68 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.417 -0.802 . . . . 0.0 109.23 179.828 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 18.0 m-85 66.26 43.84 2.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -0.856 . . . . 0.0 109.889 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 11.8 m-20 -110.83 -34.04 6.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.179 -0.951 . . . . 0.0 109.465 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 27.2 m -52.45 124.22 12.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.142 -0.974 . . . . 0.0 109.207 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.55 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.34 -24.28 66.5 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.656 -179.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.99 83.75 2.0 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.305 -0.872 . . . . 0.0 109.491 179.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.88 -154.76 16.71 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 t -147.44 158.0 43.8 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.245 -1.15 . . . . 0.0 109.488 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 19.7 m -45.75 103.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.837 . . . . 0.0 109.382 -179.971 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . 38.9 ttp180 -111.9 136.04 51.72 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.093 -1.004 . . . . 0.0 109.453 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.21 14.3 4.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.368 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.31 -23.49 35.1 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -104.65 176.38 5.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.172 -1.193 . . . . 0.0 109.798 -179.914 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.479 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--N 1.301 -1.53 0 C-N-CA 119.326 -0.95 . . . . 0.0 109.004 179.792 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -106.07 173.85 6.14 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.218 -0.926 . . . . 0.0 109.655 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -122.81 155.95 17.21 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 2.0 ttmt -41.88 150.82 0.11 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 121.283 -1.128 . . . . 0.0 109.815 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.77 -31.47 6.17 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 108.064 -2.015 . . . . 0.0 108.064 -179.105 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -71.98 75.83 0.92 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.554 -0.968 . . . . 0.0 108.563 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.38 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.223 0.535 . . . . 0.0 110.346 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -148.63 -168.27 3.05 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.017 -1.052 . . . . 0.0 110.09 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.62 -88.97 0.22 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.773 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.682 ' C ' HD22 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -148.52 -74.74 0.18 Allowed 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.505 -0.747 . . . . 0.0 109.528 -179.585 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 10' ' ' ARG . 3.6 mm? -108.87 33.74 4.07 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.718 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.417 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.23 -20.6 66.17 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.148 -0.97 . . . . 0.0 109.336 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 57.2 65.92 1.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.854 . . . . 0.0 109.703 179.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.7 OUTLIER -127.77 -32.35 2.36 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.213 -0.929 . . . . 0.0 109.612 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -56.67 126.9 28.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.931 . . . . 0.0 109.259 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.0 t -66.37 -33.92 76.8 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.235 0.54 . . . . 0.0 109.583 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.67 130.82 56.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 109.354 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 58.72 -166.41 7.44 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.431 -1.467 . . . . 0.0 109.431 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' C ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.41 179.65 4.24 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.226 -1.161 . . . . 0.0 109.482 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.408 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.3 m -43.76 130.2 5.55 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.352 -0.843 . . . . 0.0 109.258 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -127.91 123.09 34.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.29 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.71 24.4 14.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.242 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.65 -19.65 39.62 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.1 mttm -109.26 171.9 7.16 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.108 -1.231 . . . . 0.0 109.346 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m . . . . . 0 C--N 1.299 -1.593 0 C-N-CA 119.309 -0.957 . . . . 0.0 109.031 179.789 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.517 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.387 0.613 . . . . 0.0 109.544 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.8 mmtt -88.74 -178.8 5.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 109.877 -179.523 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -135.3 169.43 23.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp -47.3 148.92 1.14 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 120.924 -1.339 . . . . 0.0 109.615 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.21 -33.18 5.23 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 107.831 -2.107 . . . . 0.0 107.831 -178.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -70.38 75.25 0.54 Allowed 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 4.0 ptmt -31.76 151.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.451 0.643 . . . . 0.0 110.249 -179.079 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.06 -164.24 1.65 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.17 -0.956 . . . . 0.0 109.542 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -94.06 -164.76 1.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 109.233 179.99 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.558 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -75.72 -25.5 56.67 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.085 -1.01 . . . . 0.0 109.177 179.727 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.529 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -156.63 91.05 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 0.0 109.393 179.75 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.534 ' C ' ' CD2' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -114.98 -15.02 11.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.245 -0.909 . . . . 0.0 109.295 -179.866 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CD2' ' C ' ' A' ' 12' ' ' MET . 1.5 m-85 55.79 30.66 16.14 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.875 . . . . 0.0 109.591 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . 0.446 ' CG ' ' HB3' ' A' ' 12' ' ' MET . 3.3 p30 -101.86 -31.15 10.86 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.166 -0.959 . . . . 0.0 109.345 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -54.67 124.5 16.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.108 -0.995 . . . . 0.0 108.918 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.517 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -66.29 -30.87 71.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 121.354 0.597 . . . . 0.0 109.484 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -130.96 128.06 39.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.306 -0.872 . . . . 0.0 109.393 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.45 -151.75 34.91 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.38 -157.67 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -1.155 . . . . 0.0 109.621 -179.963 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 9' ' ' SER . 21.8 m -86.09 96.7 9.96 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 109.529 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 24.8 ttp180 -95.04 139.35 31.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.046 -1.034 . . . . 0.0 109.786 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.9 m 53.63 20.63 2.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -0.01 81.92 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.9 mtmm -118.52 164.91 14.59 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.139 -1.212 . . . . 0.0 109.882 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 N--CA 1.488 1.458 0 C-N-CA 119.299 -0.96 . . . . 0.0 108.782 179.597 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' CYS . . . . . 0.591 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.42 0.629 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.557 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -82.52 162.68 21.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.334 -0.854 . . . . 0.0 109.668 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.66 160.08 18.19 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.964 -1.655 . . . . 0.0 108.964 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -50.98 146.78 5.71 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.161 -1.199 . . . . 0.0 110.715 -179.401 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 71.51 -10.92 3.43 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 179.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.67 36.69 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.576 -1.543 . . . . 0.0 111.392 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 51.67 161.19 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.122 -0.987 . . . . 0.0 110.988 179.731 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' GLY . 24.4 p 179.05 -167.0 0.07 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.237 -0.914 . . . . 0.0 109.665 179.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.55 ' CB ' ' HB2' ' A' ' 12' ' ' MET . 0.3 OUTLIER -93.73 -161.8 0.88 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.426 -0.797 . . . . 0.0 109.234 -179.95 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.481 ' C ' HD12 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -91.74 -32.58 15.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.031 -1.043 . . . . 0.0 108.9 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' C ' ' A' ' 10' ' ' ARG . 1.2 mp -153.18 22.37 0.56 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.655 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' MET . . . . . 0.55 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 57.2 tpp -62.56 -17.74 60.61 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.3 m-85 63.27 49.03 3.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.471 -0.768 . . . . 0.0 110.344 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.75 -21.31 15.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 0.0 108.548 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.2 m -56.23 125.59 22.45 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 122.038 0.923 . . . . 0.0 109.264 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.591 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.1 -34.89 79.1 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.595 -179.759 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.77 ' O ' HG23 ' A' ' 17' ' ' THR . 9.7 t -154.56 89.89 1.29 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.35 -0.844 . . . . 0.0 109.346 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 151.85 -149.77 21.54 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 m -139.31 178.33 7.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.165 -1.197 . . . . 0.0 109.458 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.8 m -95.68 106.92 19.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.885 . . . . 0.0 109.729 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -118.06 135.84 53.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.484 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.26 28.81 4.45 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.323 -0.86 . . . . 0.0 109.681 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 80.02 -5.98 60.84 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 17.7 mttm -100.55 146.15 27.46 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.329 -1.1 . . . . 0.0 109.156 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER . . . . . 0 N--CA 1.488 1.443 0 O-C-N 121.163 -0.961 . . . . 0.0 109.146 -179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.563 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.343 0.592 . . . . 0.0 109.467 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.541 ' CD ' ' N ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -96.52 162.81 13.31 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.22 -0.925 . . . . 0.0 110.032 -179.537 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.659 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -107.12 161.66 13.69 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.047 -1.621 . . . . 0.0 109.047 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HE2' ' NH1' ' A' ' 21' ' ' ARG . 0.0 OUTLIER -43.56 159.81 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.178 -1.189 . . . . 0.0 109.819 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 58.03 12.13 10.58 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.2 -1.16 . . . . 0.0 110.2 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.659 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.88 16.52 1.15 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.074 -1.251 . . . . 0.0 110.625 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.477 ' O ' ' O ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER 56.33 154.98 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.207 -0.933 . . . . 0.0 110.479 179.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.461 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.3 p 178.38 -147.33 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.577 -0.702 . . . . 0.0 109.504 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.435 ' N ' ' SG ' ' A' ' 8' ' ' CYS . 0.9 OUTLIER -137.28 -142.52 0.17 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.163 -0.961 . . . . 0.0 109.396 -179.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.551 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 24.6 tpt180 -112.26 100.59 8.93 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.059 -1.026 . . . . 0.0 109.155 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.551 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 83.96 77.28 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 CA-C-O 121.419 0.628 . . . . 0.0 109.842 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.498 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 10.3 mmt -125.11 -40.39 2.15 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.307 -0.87 . . . . 0.0 108.815 179.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.2 m-85 70.69 52.51 0.31 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.496 -0.753 . . . . 0.0 110.942 178.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.498 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.0 OUTLIER -116.76 -23.85 7.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 108.621 178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 38.7 m -50.79 126.88 16.97 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.897 0.856 . . . . 0.0 109.605 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.563 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 4.1 t -58.22 -27.38 63.87 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-O 121.217 0.532 . . . . 0.0 109.638 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.594 HG23 ' O ' ' A' ' 17' ' ' THR . 5.1 t -154.34 75.55 1.0 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.214 -0.929 . . . . 0.0 109.698 179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 149.5 -167.16 29.71 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 179.812 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 4.6 m -127.37 -164.55 1.37 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.223 -1.163 . . . . 0.0 109.715 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 2.7 m -79.43 116.34 19.6 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.277 -0.89 . . . . 0.0 110.114 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.547 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -114.79 115.79 27.57 Favored 'General case' 0 C--N 1.304 -1.399 0 O-C-N 121.284 -0.885 . . . . 0.0 109.457 179.458 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 66.04 33.94 7.29 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.433 -0.792 . . . . 0.0 110.12 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 84.82 -11.38 59.87 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.13 -1.188 . . . . 0.0 110.13 179.573 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.547 ' O ' ' N ' ' A' ' 21' ' ' ARG . 12.1 mttt -115.43 -175.55 2.73 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.099 -1.236 . . . . 0.0 109.371 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -73.79 172.24 11.87 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.217 -0.927 . . . . 0.0 109.463 179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.396 0 O-C-N 119.904 -1.748 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.539 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.21 0.529 . . . . 0.0 109.651 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.522 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 1.2 mptm? -83.52 157.67 22.28 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.278 -0.889 . . . . 0.0 109.96 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -90.46 157.95 26.06 Favored Glycine 0 N--CA 1.49 2.251 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 179.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -49.46 157.88 0.47 Allowed 'General case' 0 C--N 1.305 -1.354 0 O-C-N 121.123 -1.222 . . . . 0.0 110.234 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 62.56 7.48 15.27 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 110.244 -1.142 . . . . 0.0 110.244 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.503 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.26 24.75 0.42 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.021 -1.281 . . . . 0.0 110.833 -179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.41 156.17 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.063 -1.023 . . . . 0.0 110.598 -179.955 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 22.1 p 177.47 -165.57 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.548 -0.72 . . . . 0.0 109.745 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.437 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 8.4 t -101.53 -145.14 0.35 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.395 -0.816 . . . . 0.0 109.295 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.461 ' CG ' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -95.0 -24.22 17.03 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.099 -1.001 . . . . 0.0 109.7 179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 1.014 HD23 ' OH ' ' A' ' 13' ' ' TYR . 2.7 mp -133.08 -105.91 0.25 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.229 -0.919 . . . . 0.0 109.479 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.496 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.9 OUTLIER 67.41 -58.16 0.43 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.895 -1.128 . . . . 0.0 109.846 179.824 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 1.014 ' OH ' HD23 ' A' ' 11' ' ' LEU . 42.8 m-85 71.02 45.49 0.51 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.434 -0.791 . . . . 0.0 109.725 -179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 3.3 m-20 -104.23 -20.76 13.68 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.111 -0.993 . . . . 0.0 109.231 179.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.5 m -47.42 127.11 10.64 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.397 -0.814 . . . . 0.0 109.532 179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.539 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 5.0 t -66.18 -13.15 59.78 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-O 121.395 0.617 . . . . 0.0 109.522 -179.901 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.11 117.64 4.62 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.281 -0.887 . . . . 0.0 109.405 179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.33 -153.12 24.96 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 31.7 t -137.09 -158.96 0.91 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.195 -1.18 . . . . 0.0 109.56 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.403 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 6.3 m -83.0 114.71 21.45 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.244 -0.91 . . . . 0.0 109.647 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 23.4 mtp180 -104.57 117.46 34.19 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.1 -1.0 . . . . 0.0 109.488 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.462 ' HB2' ' HE3' ' A' ' 24' ' ' LYS . 3.1 m 59.84 13.49 3.61 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.506 -0.747 . . . . 0.0 109.837 179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.447 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 111.83 -24.12 15.64 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.563 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 8.2 mtmt -96.03 169.36 10.03 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.224 -1.162 . . . . 0.0 109.661 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -73.45 167.76 20.61 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.186 -0.946 . . . . 0.0 109.49 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.416 0 O-C-N 119.859 -1.776 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.568 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.1 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.269 0.557 . . . . 0.0 109.584 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 17.0 mmtt -96.83 170.5 9.13 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.456 -0.777 . . . . 0.0 109.661 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.09 151.97 18.01 Favored Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.386 -1.486 . . . . 0.0 109.386 179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.523 ' HG2' ' N ' ' A' ' 26' ' ' NH2 . 0.0 OUTLIER -51.85 155.22 1.81 Allowed 'General case' 0 C--N 1.306 -1.295 0 O-C-N 121.177 -1.19 . . . . 0.0 110.319 -179.544 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.453 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 67.13 0.25 9.41 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 110.634 -0.986 . . . . 0.0 110.634 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.16 27.25 0.33 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.82 -1.4 . . . . 0.0 110.993 -179.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER 55.79 155.32 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.926 -1.109 . . . . 0.0 110.568 179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.8 p 178.84 -175.17 0.2 Allowed 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.38 -0.825 . . . . 0.0 109.974 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.461 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 38.9 t -98.68 -142.01 0.31 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.364 -0.835 . . . . 0.0 109.233 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -92.34 -62.45 1.4 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 120.93 -1.106 . . . . 0.0 109.546 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.421 HD23 ' OH ' ' A' ' 13' ' ' TYR . 1.4 mp -123.11 58.87 1.09 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.28 -0.887 . . . . 0.0 109.591 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 9.0 mmm -81.93 -10.32 59.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.164 -0.96 . . . . 0.0 109.507 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.421 ' OH ' HD23 ' A' ' 11' ' ' LEU . 93.0 m-85 48.87 47.94 20.89 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.178 -0.951 . . . . 0.0 109.543 179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 1.2 p30 -115.74 -19.55 10.45 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 109.694 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 37.1 m -62.38 124.8 21.88 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.224 -0.922 . . . . 0.0 109.933 -179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.568 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.73 -25.52 66.55 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-O 121.356 0.598 . . . . 0.0 109.707 179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -151.14 112.33 4.34 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.162 -0.961 . . . . 0.0 109.558 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.42 -146.06 16.81 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 27.4 m -149.02 -169.11 3.29 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.297 -1.119 . . . . 0.0 109.446 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.461 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.9 m -81.11 108.65 14.95 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.275 -0.891 . . . . 0.0 109.506 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.499 ' N ' ' O ' ' A' ' 24' ' ' LYS . 18.2 ttt180 -104.57 121.81 44.29 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.244 -0.91 . . . . 0.0 109.677 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 m 52.59 20.59 1.55 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.292 -0.88 . . . . 0.0 109.87 179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.525 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 103.44 -21.35 39.49 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.842 -1.303 . . . . 0.0 109.842 179.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.564 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 14.4 mttp -93.67 159.64 15.12 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.197 -1.178 . . . . 0.0 109.616 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.494 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -72.05 167.93 19.16 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.186 -0.946 . . . . 0.0 109.632 -179.699 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.523 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.304 -1.401 0 O-C-N 119.947 -1.72 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.7 p . . . . . 0 N--CA 1.49 1.558 0 CA-C-O 121.302 0.572 . . . . 0.0 109.552 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -84.36 158.96 20.97 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.276 -0.89 . . . . 0.0 109.54 -179.851 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.3 162.66 17.97 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.204 -1.559 . . . . 0.0 109.204 179.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.432 ' HD2' HG21 ' A' ' 17' ' ' THR . 0.0 OUTLIER -55.64 149.47 14.04 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.079 -1.248 . . . . 0.0 109.667 -179.957 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.84 -23.37 29.14 Favored Glycine 0 N--CA 1.487 2.036 0 N-CA-C 108.008 -2.037 . . . . 0.0 108.008 -179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.541 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.3 74.78 3.86 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 121.737 -0.861 . . . . 0.0 108.966 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -22.51 145.09 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.854 0.835 . . . . 0.0 112.081 -179.247 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.4 p -147.75 -166.49 2.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.423 -0.798 . . . . 0.0 110.112 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 33.4 t -93.92 -122.87 0.1 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.347 -0.846 . . . . 0.0 109.27 -179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.487 ' HG3' HD12 ' A' ' 11' ' ' LEU . 0.9 OUTLIER -118.75 -61.56 1.64 Allowed 'General case' 0 N--CA 1.489 1.505 0 O-C-N 120.719 -1.238 . . . . 0.0 109.756 -179.88 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.643 HD23 ' OH ' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -123.2 80.88 1.82 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.225 -0.922 . . . . 0.0 109.793 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 1.7 mmm -114.27 -25.33 8.5 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.187 -0.946 . . . . 0.0 109.156 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.643 ' OH ' HD23 ' A' ' 11' ' ' LEU . 29.1 m-85 70.29 38.13 1.48 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.357 -0.84 . . . . 0.0 109.656 179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' HB2' ' HE2' ' A' ' 2' ' ' LYS . 1.1 p30 -103.33 -36.24 8.11 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.222 -0.924 . . . . 0.0 109.218 179.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 35.3 m -49.53 125.72 11.92 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.246 -0.909 . . . . 0.0 109.409 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -66.65 -15.06 63.21 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 121.312 0.577 . . . . 0.0 109.722 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.474 ' OG1' ' N ' ' A' ' 18' ' ' GLY . 5.4 t -99.42 -144.57 0.33 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.284 -0.885 . . . . 0.0 109.125 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.474 ' N ' ' OG1' ' A' ' 17' ' ' THR . . . -50.42 -99.43 0.01 OUTLIER Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.413 ' O ' ' C ' ' A' ' 20' ' ' CYS . 21.3 p -151.54 176.07 11.69 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.078 -1.248 . . . . 0.0 109.432 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.4 m -44.28 129.1 6.34 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 109.303 179.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' O ' ' N ' ' A' ' 24' ' ' LYS . 1.2 ttt180 -131.47 140.93 49.68 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.033 -1.042 . . . . 0.0 109.491 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.5 m 47.43 24.64 0.5 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.178 -0.951 . . . . 0.0 109.271 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.34 -23.68 17.5 Favored Glycine 0 N--CA 1.49 2.261 0 N-CA-C 109.547 -1.421 . . . . 0.0 109.547 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.604 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -105.57 165.61 11.03 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.207 -1.172 . . . . 0.0 109.914 -179.774 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -73.27 158.36 35.3 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.148 -0.97 . . . . 0.0 109.467 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.414 ' N ' ' HG3' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.303 -1.445 0 O-C-N 119.991 -1.693 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.53 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 25.4 p . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.302 0.572 . . . . 0.0 109.669 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 1.7 mmtm -113.21 -167.11 1.15 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.33 -0.857 . . . . 0.0 110.77 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -130.35 -178.01 15.19 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.014 -1.634 . . . . 0.0 109.014 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.93 151.23 15.09 Favored 'General case' 0 C--N 1.307 -1.243 0 O-C-N 121.084 -1.244 . . . . 0.0 109.59 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.42 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 94.93 -29.79 8.84 Favored Glycine 0 N--CA 1.485 1.959 0 N-CA-C 107.772 -2.131 . . . . 0.0 107.772 -179.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -69.42 73.89 0.36 Allowed 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 178.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.59 150.3 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 121.311 0.577 . . . . 0.0 110.371 -179.557 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.426 ' O ' ' O ' ' A' ' 23' ' ' GLY . 29.8 p -159.51 -163.57 1.2 Allowed 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.202 -0.936 . . . . 0.0 109.789 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.459 ' CB ' ' HG3' ' A' ' 12' ' ' MET . 7.7 t -94.99 -125.75 0.12 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.335 -0.853 . . . . 0.0 109.196 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.8 ttt180 -122.46 -31.38 3.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.748 -1.22 . . . . 0.0 109.748 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -133.37 19.72 3.99 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.183 -0.948 . . . . 0.0 109.995 -179.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.459 ' HG3' ' CB ' ' A' ' 9' ' ' SER . 0.0 OUTLIER -59.12 -25.42 63.82 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.959 -1.088 . . . . 0.0 108.853 179.488 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 53.28 80.57 0.1 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.309 -0.87 . . . . 0.0 109.487 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.413 ' O ' ' C ' ' A' ' 15' ' ' CYS . 4.4 m-20 -136.35 -38.25 0.68 Allowed 'General case' 0 C--N 1.303 -1.417 0 O-C-N 121.519 -0.738 . . . . 0.0 109.286 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.413 ' C ' ' O ' ' A' ' 14' ' ' ASP . 7.6 m -43.55 124.74 3.67 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 122.085 0.945 . . . . 0.0 109.535 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.53 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -67.15 -24.15 65.87 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 121.416 0.627 . . . . 0.0 109.432 179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.8 p -130.62 94.27 3.6 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.335 -0.853 . . . . 0.0 109.21 179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 103.68 -163.69 15.43 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.409 ' O ' ' C ' ' A' ' 20' ' ' CYS . 51.4 p -129.77 171.14 12.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.257 -1.143 . . . . 0.0 109.532 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.409 ' C ' ' O ' ' A' ' 19' ' ' SER . 7.1 m -43.61 130.31 5.32 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.3 -0.875 . . . . 0.0 109.203 179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -121.2 129.35 53.16 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.158 -0.964 . . . . 0.0 109.369 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 43.7 m 48.19 22.62 0.44 Allowed 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.36 -0.837 . . . . 0.0 109.586 -179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.426 ' O ' ' O ' ' A' ' 8' ' ' CYS . . . 102.33 -36.14 4.48 Favored Glycine 0 N--CA 1.49 2.289 0 N-CA-C 109.892 -1.283 . . . . 0.0 109.892 179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.569 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.3 mttt -95.88 160.16 14.61 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.091 -1.241 . . . . 0.0 109.59 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.15 165.8 8.74 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.055 -1.028 . . . . 0.0 109.326 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.458 0 O-C-N 120.148 -1.595 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.485 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.521 0 CA-C-O 121.256 0.551 . . . . 0.0 109.65 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.513 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.1 OUTLIER -75.81 158.45 32.16 Favored 'General case' 0 C--N 1.305 -1.368 0 O-C-N 121.216 -0.927 . . . . 0.0 110.019 -179.724 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.527 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -99.32 158.42 19.95 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.338 -1.505 . . . . 0.0 109.338 179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.404 ' C ' ' O ' ' A' ' 3' ' ' GLY . 0.0 OUTLIER -45.3 156.53 0.11 Allowed 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.059 -1.26 . . . . 0.0 110.136 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 55.62 11.0 3.57 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 110.725 -0.95 . . . . 0.0 110.725 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.527 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -80.92 22.49 0.61 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.808 -1.407 . . . . 0.0 110.707 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 56.41 151.33 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.07 -1.019 . . . . 0.0 110.713 -179.672 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.486 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 19.9 p 177.73 -151.06 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.393 -0.817 . . . . 0.0 109.881 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.446 ' O ' ' HB3' ' A' ' 20' ' ' CYS . 68.2 m -115.27 -123.48 0.29 Allowed 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.375 -0.828 . . . . 0.0 109.509 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 21.7 mmm180 -118.17 -41.24 2.88 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.777 -1.202 . . . . 0.0 109.798 -179.768 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.58 70.33 1.01 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.194 -0.941 . . . . 0.0 109.623 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 65.2 mtm -102.56 -7.63 21.68 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.205 -0.934 . . . . 0.0 109.535 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 62.68 52.6 2.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.908 . . . . 0.0 109.61 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -126.81 -9.07 6.09 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.116 -0.99 . . . . 0.0 109.811 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.495 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 83.4 m -72.23 119.65 16.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.058 -1.026 . . . . 0.0 109.804 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 4.2 t -68.82 -13.42 62.39 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.577 -179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 23.2 p -122.44 2.93 9.69 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.881 -1.137 . . . . 0.0 111.507 -178.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.495 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 169.01 -124.0 1.13 Allowed Glycine 0 N--CA 1.494 2.52 0 C-N-CA 118.927 -1.606 . . . . 0.0 110.491 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.454 ' O ' ' SG ' ' A' ' 15' ' ' CYS . 0.1 OUTLIER -132.83 -161.82 1.18 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.434 -1.039 . . . . 0.0 109.714 -179.49 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 8.1 m -86.07 128.39 34.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.413 -0.804 . . . . 0.0 110.262 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.0 141.75 50.71 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.326 -0.859 . . . . 0.0 108.819 179.244 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 13.0 t 47.72 23.55 0.44 Allowed 'General case' 0 C--N 1.301 -1.524 0 O-C-N 121.307 -0.87 . . . . 0.0 109.496 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.52 -33.23 5.44 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.726 -1.35 . . . . 0.0 109.726 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.6 mttp -96.15 171.66 8.46 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.109 -1.23 . . . . 0.0 109.806 -179.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m -69.03 172.62 6.45 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.352 -0.843 . . . . 0.0 109.558 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.344 0 O-C-N 119.859 -1.776 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.542 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.326 0.584 . . . . 0.0 109.597 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 2.7 mptp? -82.33 157.78 23.65 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.327 -0.858 . . . . 0.0 109.893 -179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -89.51 162.0 30.24 Favored Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.021 -1.632 . . . . 0.0 109.021 179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.522 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -54.57 156.26 3.57 Favored 'General case' 0 C--N 1.304 -1.393 0 O-C-N 121.028 -1.278 . . . . 0.0 109.819 -179.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 64.79 6.22 22.66 Favored Glycine 0 N--CA 1.492 2.411 0 N-CA-C 110.314 -1.114 . . . . 0.0 110.314 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.488 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.0 26.68 0.33 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.912 -1.346 . . . . 0.0 110.7 -179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.43 155.55 0.01 OUTLIER 'General case' 0 C--N 1.307 -1.283 0 O-C-N 120.979 -1.076 . . . . 0.0 110.872 -179.998 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.427 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 16.5 p -179.2 -158.67 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.38 -0.825 . . . . 0.0 109.745 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.503 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 3.5 t -106.96 -102.37 0.35 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.226 -0.921 . . . . 0.0 109.648 -179.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.461 ' N ' ' OG ' ' A' ' 9' ' ' SER . 5.0 ttt180 -140.23 -44.36 0.42 Allowed 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.075 -1.016 . . . . 0.0 109.857 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -140.22 39.01 1.92 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.112 -0.992 . . . . 0.0 109.846 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.503 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 7.9 mmt -78.78 -22.48 46.29 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.074 -1.016 . . . . 0.0 109.156 179.758 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 38.9 m-85 60.85 73.14 0.49 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.307 -0.871 . . . . 0.0 109.778 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.416 ' OD1' ' HB2' ' A' ' 12' ' ' MET . 0.0 OUTLIER -134.94 9.58 3.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.324 -0.86 . . . . 0.0 109.322 179.554 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 18.5 m -86.13 125.41 33.47 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.178 -0.951 . . . . 0.0 109.794 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.542 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.1 t -66.7 -23.89 66.18 Favored 'General case' 0 C--N 1.292 -1.903 0 CA-C-N 115.929 -0.578 . . . . 0.0 109.717 -179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -153.18 72.04 0.93 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.16 -0.963 . . . . 0.0 109.667 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.468 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 150.99 -167.96 30.63 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 25.3 t -138.55 161.32 37.37 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -1.117 . . . . 0.0 109.299 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.495 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 4.3 m -52.08 127.27 21.05 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.209 -0.932 . . . . 0.0 109.324 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.6 OUTLIER -139.12 121.75 16.32 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.164 -0.96 . . . . 0.0 109.816 -179.662 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 63.55 10.29 4.83 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.358 -0.839 . . . . 0.0 109.908 179.553 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.78 -2.44 33.97 Favored Glycine 0 N--CA 1.49 2.283 0 N-CA-C 110.007 -1.237 . . . . 0.0 110.007 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.572 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -121.99 174.48 6.88 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.045 -1.268 . . . . 0.0 109.64 179.631 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.522 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.81 170.97 14.23 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.465 -0.772 . . . . 0.0 109.62 179.981 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.343 0 O-C-N 119.919 -1.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.525 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.498 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 9.6 mmtt -107.48 -166.75 1.18 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.247 -0.908 . . . . 0.0 109.946 -179.33 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -137.46 160.54 25.15 Favored Glycine 0 N--CA 1.489 2.221 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.46 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 2.4 pttp -53.55 152.0 5.37 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 120.959 -1.318 . . . . 0.0 109.451 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 96.03 -31.5 7.26 Favored Glycine 0 N--CA 1.486 2.024 0 N-CA-C 107.61 -2.196 . . . . 0.0 107.61 -178.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.506 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.33 80.21 3.84 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 178.751 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 2.9 pttt -28.44 149.14 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 CA-C-O 121.443 0.639 . . . . 0.0 110.739 -179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -150.98 -162.32 1.53 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.099 -1.001 . . . . 0.0 109.904 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.51 ' HB2' ' CG ' ' A' ' 12' ' ' MET . 73.2 m -94.07 -101.2 0.14 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.209 -0.932 . . . . 0.0 109.703 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -167.48 115.65 0.79 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.16 -0.962 . . . . 0.0 109.509 -179.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.3 OUTLIER 76.02 16.06 2.36 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.322 -0.861 . . . . 0.0 109.612 179.813 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.51 ' CG ' ' HB2' ' A' ' 9' ' ' SER . 36.4 mmt -74.17 -9.31 58.49 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.123 -0.986 . . . . 0.0 109.265 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.422 ' C ' ' O ' ' A' ' 12' ' ' MET . 19.2 m-85 42.52 57.05 3.58 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.337 -0.852 . . . . 0.0 109.549 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -116.55 -22.08 8.87 Favored 'General case' 0 N--CA 1.487 1.405 0 O-C-N 121.28 -0.887 . . . . 0.0 109.24 179.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.8 m -61.76 124.25 20.21 Favored 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.192 0.996 . . . . 0.0 109.837 -179.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.525 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -66.9 -36.94 83.41 Favored 'General case' 0 C--N 1.293 -1.871 0 CA-C-N 115.677 -0.692 . . . . 0.0 109.72 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.5 t -128.9 72.48 1.46 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.337 -0.852 . . . . 0.0 109.408 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 141.63 -158.3 26.54 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.514 -1.435 . . . . 0.0 109.514 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.3 p -148.63 168.16 23.57 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.327 -1.101 . . . . 0.0 109.376 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.45 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 8.6 m -57.65 92.2 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.258 -0.901 . . . . 0.0 109.345 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.534 ' N ' ' O ' ' A' ' 24' ' ' LYS . 8.8 ttm180 -103.7 135.23 45.64 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.325 -0.859 . . . . 0.0 109.403 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 9.1 t 58.6 22.13 9.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.247 -0.908 . . . . 0.0 109.379 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 90.13 -14.77 61.3 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.656 -1.378 . . . . 0.0 109.656 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.605 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 32.3 mttm -107.15 172.48 6.8 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.12 -1.223 . . . . 0.0 109.518 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.46 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -72.2 169.15 16.74 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.096 -1.003 . . . . 0.0 109.217 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.517 0 O-C-N 120.058 -1.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.576 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.279 0.561 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.463 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 15.4 mmtm -122.52 -167.65 1.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 109.838 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.431 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -143.72 161.88 27.74 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.514 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.3 OUTLIER -41.1 148.52 0.11 Allowed 'General case' 0 C--N 1.306 -1.294 0 O-C-N 121.365 -1.08 . . . . 0.0 110.107 -179.94 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.97 -34.18 5.09 Favored Glycine 0 N--CA 1.487 2.034 0 N-CA-C 107.963 -2.055 . . . . 0.0 107.963 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.51 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -78.62 80.57 4.99 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.591 -0.946 . . . . 0.0 108.785 178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -33.09 155.61 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-O 121.248 0.547 . . . . 0.0 110.39 -179.567 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.7 p -142.48 -145.76 0.18 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.032 -1.043 . . . . 0.0 109.904 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.541 ' O ' ' CB ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -111.95 7.16 19.83 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 120.816 -1.178 . . . . 0.0 110.351 -178.834 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.547 ' HA ' ' HB3' ' A' ' 20' ' ' CYS . 0.0 OUTLIER 82.95 -13.62 0.8 Allowed 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.638 -0.664 . . . . 0.0 109.772 -179.778 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -161.06 22.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.044 -1.035 . . . . 0.0 109.503 179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.442 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -83.25 -21.13 33.43 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.183 -0.948 . . . . 0.0 109.049 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.442 ' HB2' ' O ' ' A' ' 12' ' ' MET . 6.7 m-85 61.95 66.95 0.78 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.888 . . . . 0.0 109.837 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.48 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 15.9 p-10 -118.3 -20.25 8.62 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.189 -0.945 . . . . 0.0 109.257 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 3.9 m -60.68 127.38 31.39 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-O 121.919 0.866 . . . . 0.0 109.22 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.576 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.9 t -61.87 -41.1 97.45 Favored 'General case' 0 C--N 1.293 -1.856 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.3 t -131.6 120.75 23.29 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.409 -0.807 . . . . 0.0 108.977 179.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 109.18 -152.51 17.05 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.299 -1.52 . . . . 0.0 109.299 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.5 m -150.92 161.04 43.47 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.086 -1.244 . . . . 0.0 109.711 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.547 ' HB3' ' HA ' ' A' ' 10' ' ' ARG . 3.0 m -48.51 117.56 2.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.232 -0.917 . . . . 0.0 109.262 179.752 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.522 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.8 ttm180 -113.65 136.32 52.96 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.043 -1.036 . . . . 0.0 109.333 179.615 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER 49.26 27.32 1.82 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 109.437 -179.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.36 -22.22 21.06 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 7.1 mtmt -100.35 168.42 9.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.172 -1.193 . . . . 0.0 109.651 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -72.63 168.75 18.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 120.936 -1.102 . . . . 0.0 108.829 179.465 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.406 0 O-C-N 120.059 -1.651 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.395 0.617 . . . . 0.0 109.717 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.528 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -71.11 159.67 34.28 Favored 'General case' 0 C--N 1.306 -1.309 0 O-C-N 121.318 -0.864 . . . . 0.0 109.603 179.883 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.66 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -105.15 168.96 16.02 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.323 -1.511 . . . . 0.0 109.323 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -55.73 163.12 1.47 Allowed 'General case' 0 N--CA 1.486 1.375 0 O-C-N 121.086 -1.244 . . . . 0.0 109.655 -179.88 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.481 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 43.84 25.1 0.56 Allowed Glycine 0 N--CA 1.49 2.293 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.66 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -79.59 21.86 0.49 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -1.126 . . . . 0.0 111.119 -179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.494 ' C ' ' O ' ' A' ' 6' ' ' ALA . 12.1 pttm 34.72 43.1 0.09 Allowed 'General case' 0 N--CA 1.498 1.939 0 CA-C-O 121.992 0.901 . . . . 0.0 109.624 179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.64 ' N ' ' O ' ' A' ' 23' ' ' GLY . 20.7 p -68.52 -148.95 0.01 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 CA-C-O 121.44 0.638 . . . . 0.0 109.923 -179.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' HG3' ' A' ' 12' ' ' MET . 0.6 OUTLIER -106.53 -140.45 0.37 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 109.575 -179.67 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.483 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.9 ttp180 -132.98 116.48 16.47 Favored 'General case' 0 N--CA 1.484 1.235 0 O-C-N 121.111 -0.993 . . . . 0.0 108.889 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 11' ' ' LEU . 0.3 OUTLIER 63.42 45.57 4.78 Favored 'General case' 0 C--N 1.299 -1.611 0 O-C-N 121.723 -0.61 . . . . 0.0 109.854 179.882 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.483 ' HG3' ' HB3' ' A' ' 9' ' ' SER . 1.4 mmm -100.06 -5.37 28.11 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.379 -0.826 . . . . 0.0 109.235 179.452 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 55.07 53.4 10.3 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.358 -0.839 . . . . 0.0 109.445 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.497 ' HB3' ' HD3' ' A' ' 2' ' ' LYS . 56.2 m-20 -124.12 -28.89 3.66 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.268 -0.895 . . . . 0.0 109.715 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 89.2 m -44.65 125.3 4.78 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 109.367 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.9 t -64.38 -28.69 69.86 Favored 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.41 -179.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.455 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.3 p -153.66 31.8 0.46 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.024 -1.047 . . . . 0.0 109.73 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -154.9 -159.62 9.39 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.476 ' O ' ' N ' ' A' ' 21' ' ' ARG . 0.5 OUTLIER -133.97 122.91 23.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.374 -1.074 . . . . 0.0 109.219 179.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.432 ' C ' ' O ' ' A' ' 19' ' ' SER . 1.6 m -43.01 97.71 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.286 -0.884 . . . . 0.0 109.53 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 19' ' ' SER . 0.1 OUTLIER -113.32 137.82 50.94 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.182 -0.948 . . . . 0.0 109.268 -179.787 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 47.47 24.65 0.51 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.293 -0.879 . . . . 0.0 109.042 -179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.64 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 87.0 -21.47 19.75 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 -179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.481 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 23.7 mttt -93.09 134.07 35.62 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.839 -1.389 . . . . 0.0 109.117 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.491 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.5 OUTLIER -66.54 163.97 17.55 Favored 'General case' 0 C--N 1.297 -1.71 0 O-C-N 121.568 -0.708 . . . . 0.0 109.526 -179.721 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.563 0 O-C-N 120.122 -1.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.556 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.318 0.58 . . . . 0.0 109.489 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 8.4 mmtp -88.79 166.25 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.266 -0.896 . . . . 0.0 109.701 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.41 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -118.67 153.02 17.17 Favored Glycine 0 N--CA 1.49 2.246 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -42.43 147.83 0.25 Allowed 'General case' 0 C--N 1.305 -1.33 0 O-C-N 121.323 -1.104 . . . . 0.0 110.02 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.97 -29.34 8.79 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 108.162 -1.975 . . . . 0.0 108.162 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.86 75.17 0.46 Allowed 'General case' 0 C--N 1.305 -1.358 0 O-C-N 121.541 -0.976 . . . . 0.0 108.529 179.331 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -28.26 149.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.849 0 CA-C-O 121.614 0.721 . . . . 0.0 110.586 -179.611 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 27.7 p -152.11 -156.96 0.75 Allowed 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.213 -0.93 . . . . 0.0 109.799 -179.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.481 ' HB3' ' HG2' ' A' ' 12' ' ' MET . 10.7 t -93.42 -110.86 0.11 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.289 -0.882 . . . . 0.0 109.52 -179.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.443 ' N ' ' OG ' ' A' ' 9' ' ' SER . 52.4 ttt180 -135.35 -45.7 0.69 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.775 -1.203 . . . . 0.0 110.024 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.16 45.57 2.54 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.006 -1.059 . . . . 0.0 109.951 -179.695 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.481 ' HG2' ' HB3' ' A' ' 9' ' ' SER . 14.5 mmt -80.36 -36.98 33.3 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.069 -1.02 . . . . 0.0 109.058 179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.416 ' HB2' ' O ' ' A' ' 12' ' ' MET . 5.0 m-30 60.16 35.24 21.13 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.43 -0.794 . . . . 0.0 109.989 179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -94.96 -12.15 27.26 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.123 -0.985 . . . . 0.0 108.962 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 15.2 m -57.61 133.64 55.47 Favored 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.105 0.955 . . . . 0.0 109.607 179.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.556 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.0 t -66.05 -30.38 70.9 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.257 -179.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.455 ' O ' HG23 ' A' ' 17' ' ' THR . 1.7 t -142.32 81.0 1.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.952 -1.092 . . . . 0.0 109.952 -179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 137.48 -160.0 25.0 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.731 -1.347 . . . . 0.0 109.731 179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -139.24 164.58 29.45 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.409 -1.054 . . . . 0.0 109.388 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 2.8 m -50.5 99.62 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.2 -0.937 . . . . 0.0 109.521 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -112.98 145.93 39.95 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.139 -0.976 . . . . 0.0 109.746 -179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 42.7 t 55.31 26.33 8.49 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.443 -0.786 . . . . 0.0 109.519 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.67 -6.97 59.88 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.31 -1.516 . . . . 0.0 109.31 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.61 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -121.03 179.36 4.4 Favored 'General case' 0 N--CA 1.487 1.388 0 O-C-N 121.196 -1.179 . . . . 0.0 109.485 -179.863 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.507 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.62 166.76 22.68 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 119.502 -0.879 . . . . 0.0 108.954 179.421 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.299 -1.622 0 O-C-N 120.151 -1.593 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 4.1 p . . . . . 0 N--CA 1.489 1.519 0 CA-C-O 121.291 0.567 . . . . 0.0 109.482 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.507 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 4.6 mmtp -106.94 -176.77 3.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.21 -0.931 . . . . 0.0 110.107 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -117.54 163.91 12.66 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.015 -1.634 . . . . 0.0 109.015 179.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.4 pttt -50.25 156.98 0.73 Allowed 'General case' 0 C--N 1.305 -1.357 0 O-C-N 120.948 -1.324 . . . . 0.0 109.19 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 94.66 -32.08 6.33 Favored Glycine 0 N--CA 1.485 1.962 0 N-CA-C 107.758 -2.137 . . . . 0.0 107.758 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.494 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -74.04 77.23 1.71 Allowed 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.347 -0.982 . . . . 0.0 108.347 178.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.5 OUTLIER -30.71 150.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.579 0 CA-C-O 121.338 0.589 . . . . 0.0 110.338 -179.448 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.3 p -146.79 -166.09 2.41 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.324 -0.86 . . . . 0.0 109.986 -179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 3.1 m -94.31 -102.63 0.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.327 -0.858 . . . . 0.0 109.611 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 5.1 ttm180 -148.31 112.92 5.35 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.158 -0.964 . . . . 0.0 109.174 179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.516 ' N ' HD23 ' A' ' 11' ' ' LEU . 1.5 mt 64.01 28.25 14.34 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.445 -0.784 . . . . 0.0 109.453 -179.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.4 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 2.5 mmt -58.74 -21.71 56.0 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.315 -0.866 . . . . 0.0 109.447 -179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.4 ' HB2' ' O ' ' A' ' 12' ' ' MET . 40.5 m-85 59.27 33.96 22.81 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.273 -0.892 . . . . 0.0 109.739 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -110.41 -30.48 7.65 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.253 -0.905 . . . . 0.0 109.241 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 5.6 m -54.37 124.43 15.95 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 122.214 1.007 . . . . 0.0 109.042 179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.7 t -66.8 -25.09 66.29 Favored 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.759 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.462 ' O ' ' O ' ' A' ' 18' ' ' GLY . 54.5 p -90.73 -128.84 0.09 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.237 -0.915 . . . . 0.0 109.089 179.855 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' O ' ' A' ' 17' ' ' THR . . . -59.9 -119.33 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 86.0 p -146.52 175.45 10.56 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.126 -1.22 . . . . 0.0 109.456 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 9.3 m -45.39 103.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.236 -0.915 . . . . 0.0 109.462 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.514 ' N ' ' O ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -106.11 133.33 50.99 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 109.334 179.917 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 52.27 22.86 2.14 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.136 -0.978 . . . . 0.0 109.297 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 91.43 -19.52 46.83 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.62 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 9.1 mtpt -101.22 159.46 15.23 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.224 -1.162 . . . . 0.0 109.384 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -66.11 163.99 16.41 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.077 -1.014 . . . . 0.0 109.113 179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.469 0 O-C-N 119.999 -1.688 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.574 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 121.222 0.534 . . . . 0.0 109.759 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 27.0 mmtm -81.52 -171.73 3.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.301 -0.875 . . . . 0.0 109.618 -179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.709 ' O ' ' HB2' ' A' ' 6' ' ' ALA . . . -122.79 161.92 16.81 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.9 mtmm -58.75 162.67 3.83 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.295 -1.121 . . . . 0.0 109.777 -179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.515 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 47.79 24.14 2.8 Favored Glycine 0 N--CA 1.489 2.204 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.901 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.709 ' HB2' ' O ' ' A' ' 3' ' ' GLY . . . -78.62 21.87 0.37 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.321 -1.105 . . . . 0.0 111.479 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.515 ' C ' ' O ' ' A' ' 6' ' ' ALA . 19.9 ptmt 30.79 44.65 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.133 0 CA-C-O 121.887 0.851 . . . . 0.0 110.11 179.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.61 ' N ' ' O ' ' A' ' 23' ' ' GLY . 29.7 p -70.63 -153.64 0.02 OUTLIER 'General case' 0 C--N 1.29 -2.012 0 O-C-N 121.815 -0.553 . . . . 0.0 109.869 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.451 ' O ' ' HA2' ' A' ' 23' ' ' GLY . 1.4 t -103.26 -140.93 0.36 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 109.868 -179.551 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.544 ' O ' ' CB ' ' A' ' 11' ' ' LEU . 0.6 OUTLIER -128.43 108.43 10.55 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.067 -1.021 . . . . 0.0 109.148 -179.91 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.544 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER 80.2 53.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.555 -0.716 . . . . 0.0 109.52 -179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.8 mmm -103.27 -16.44 15.67 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.19 -0.944 . . . . 0.0 109.289 179.82 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.6 m-85 57.09 50.7 11.51 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.262 -0.899 . . . . 0.0 109.507 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.403 ' O ' ' C ' ' A' ' 15' ' ' CYS . 1.0 OUTLIER -124.13 -27.24 3.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.203 -0.936 . . . . 0.0 109.717 179.963 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.48 ' HB2' ' C ' ' A' ' 18' ' ' GLY . 64.8 m -45.47 123.08 3.92 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 122.122 0.963 . . . . 0.0 109.763 -179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.574 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.7 t -67.28 -9.95 45.96 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.736 -0.666 . . . . 0.0 111.077 -179.466 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.8 p -130.2 -5.13 4.37 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.716 -1.24 . . . . 0.0 111.006 -178.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.48 ' C ' ' HB2' ' A' ' 15' ' ' CYS . . . -170.24 -127.84 0.97 Allowed Glycine 0 N--CA 1.493 2.451 0 C-N-CA 119.377 -1.392 . . . . 0.0 110.023 -179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.422 ' C ' ' SG ' ' A' ' 15' ' ' CYS . 33.0 t -140.58 162.68 34.78 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.274 -1.133 . . . . 0.0 109.519 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.3 m -51.11 126.56 16.82 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.243 -0.91 . . . . 0.0 109.636 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.13 123.35 40.11 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.165 -0.959 . . . . 0.0 109.061 179.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 51.75 27.45 4.15 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.192 -0.942 . . . . 0.0 108.765 -179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.61 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 91.06 -32.7 5.02 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.515 ' HB3' ' HA2' ' A' ' 5' ' ' GLY . 1.4 mttm -92.73 135.85 33.74 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.366 -1.079 . . . . 0.0 109.277 -179.518 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.489 ' HB2' ' O ' ' A' ' 3' ' ' GLY . 0.6 OUTLIER -57.39 165.8 1.4 Allowed 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.944 -0.702 . . . . 0.0 109.482 -179.686 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.518 0 O-C-N 120.053 -1.654 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.557 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.492 1.632 0 CA-C-O 121.343 0.592 . . . . 0.0 109.598 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.479 ' HB3' ' CB ' ' A' ' 6' ' ' ALA . 2.5 mptt -81.84 161.7 23.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.324 -0.86 . . . . 0.0 110.115 -179.659 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -109.19 161.68 13.03 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 108.812 -1.715 . . . . 0.0 108.812 179.263 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.1 OUTLIER -41.37 150.47 0.09 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.289 -1.124 . . . . 0.0 109.926 -179.615 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 96.22 -31.57 7.26 Favored Glycine 0 N--CA 1.487 2.069 0 N-CA-C 107.881 -2.087 . . . . 0.0 107.881 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.515 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -69.11 75.89 0.34 Allowed 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.015 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -28.93 150.09 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.805 0 CA-C-O 121.399 0.619 . . . . 0.0 110.475 -179.418 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 25.9 p -157.16 -161.67 1.11 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.136 -0.978 . . . . 0.0 109.735 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.452 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 86.9 p -98.84 -143.72 0.32 Allowed 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.296 -0.877 . . . . 0.0 109.425 -179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -89.66 -30.22 18.25 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.055 -1.028 . . . . 0.0 109.445 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.48 HD23 ' HA ' ' A' ' 11' ' ' LEU . 6.3 mt -153.84 44.07 0.58 Allowed 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.177 -0.952 . . . . 0.0 109.956 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.482 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -53.31 -23.68 9.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.065 -1.022 . . . . 0.0 109.162 179.837 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 12' ' ' MET . 10.7 m-85 63.67 36.1 11.02 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.41 -0.806 . . . . 0.0 110.622 179.254 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.03 -25.47 5.77 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.087 -1.008 . . . . 0.0 109.304 179.344 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 10.8 m -52.93 126.21 19.63 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.12 -0.987 . . . . 0.0 109.157 179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.557 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -66.87 -28.04 68.01 Favored 'General case' 0 C--N 1.293 -1.861 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.349 -179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.98 135.65 47.81 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.066 -1.021 . . . . 0.0 109.719 -179.566 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 60.26 -176.29 3.89 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -108.26 -171.83 1.94 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.28 -1.129 . . . . 0.0 109.47 179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.452 ' SG ' ' O ' ' A' ' 9' ' ' SER . 9.0 m -61.37 103.34 0.3 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.303 -0.873 . . . . 0.0 109.446 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.537 ' N ' ' O ' ' A' ' 24' ' ' LYS . 28.6 tpt180 -97.81 135.72 39.17 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.294 -0.879 . . . . 0.0 109.606 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 15.1 t 51.5 32.52 8.94 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.278 -0.889 . . . . 0.0 109.718 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 80.27 -9.7 46.59 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.833 -1.307 . . . . 0.0 109.833 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.589 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.1 OUTLIER -110.94 172.02 7.12 Favored 'General case' 0 C--N 1.304 -1.379 0 O-C-N 121.015 -1.286 . . . . 0.0 109.552 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.504 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m -73.26 168.58 18.87 Favored 'General case' 0 C--N 1.3 -1.562 0 C-N-CA 119.46 -0.896 . . . . 0.0 108.839 179.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.074 -1.641 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 7.5 p . . . . . 0 N--CA 1.489 1.481 0 CA-C-O 121.303 0.573 . . . . 0.0 109.535 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 16.5 mmtt -99.04 168.96 9.76 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.353 -0.842 . . . . 0.0 109.91 -179.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.45 169.43 20.47 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.426 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.02 156.97 13.68 Favored 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.177 -1.19 . . . . 0.0 110.102 -179.548 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 70.9 -0.87 26.94 Favored Glycine 0 N--CA 1.493 2.467 0 N-CA-C 110.481 -1.048 . . . . 0.0 110.481 179.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.493 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.06 22.03 0.54 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.971 -1.311 . . . . 0.0 110.963 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 56.88 154.17 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.468 0 O-C-N 120.941 -1.099 . . . . 0.0 110.46 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 30.9 p 175.14 173.95 0.23 Allowed 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 109.211 -0.662 . . . . 0.0 109.211 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.482 ' O ' ' SG ' ' A' ' 20' ' ' CYS . 0.3 OUTLIER -93.33 -163.36 1.04 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.253 -0.904 . . . . 0.0 109.1 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.454 ' CG ' HH11 ' A' ' 10' ' ' ARG . 0.0 OUTLIER -60.61 -61.44 2.59 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.031 -1.043 . . . . 0.0 109.519 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' CZ ' ' A' ' 13' ' ' TYR . 2.6 mp -138.04 72.63 1.42 Allowed 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.274 -0.891 . . . . 0.0 109.614 -179.796 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.493 ' O ' ' CD2' ' A' ' 13' ' ' TYR . 0.0 OUTLIER -86.57 -14.9 41.55 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.105 -0.997 . . . . 0.0 109.293 -179.994 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.493 ' CD2' ' O ' ' A' ' 12' ' ' MET . 3.9 m-85 69.29 54.73 0.41 Allowed 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.201 -0.937 . . . . 0.0 110.079 179.396 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 14' ' ' ASP . 0.5 OUTLIER -130.23 -11.19 4.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.136 -0.977 . . . . 0.0 110.134 -179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 56.1 m -73.15 124.62 25.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.118 -0.989 . . . . 0.0 109.882 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -67.09 -27.4 67.32 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-O 121.369 0.604 . . . . 0.0 109.42 179.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.42 HG23 ' O ' ' A' ' 17' ' ' THR . 4.5 t -150.91 126.85 10.39 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.261 -0.899 . . . . 0.0 109.281 179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.26 -166.93 28.61 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -125.07 -167.79 1.73 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.25 -1.147 . . . . 0.0 109.673 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.482 ' SG ' ' O ' ' A' ' 9' ' ' SER . 6.9 m -85.43 117.38 24.31 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.361 -0.837 . . . . 0.0 109.728 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.475 ' N ' ' O ' ' A' ' 24' ' ' LYS . 4.2 ttt180 -122.67 131.01 53.61 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.167 -0.958 . . . . 0.0 109.268 179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.1 p 57.41 28.18 15.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.294 -0.879 . . . . 0.0 109.208 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 79.93 7.63 88.35 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.547 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 10.5 mtpt -120.26 162.34 19.58 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.191 -1.182 . . . . 0.0 110.0 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.426 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 1.2 m -73.63 167.58 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.462 -0.774 . . . . 0.0 109.301 179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.304 -1.392 0 O-C-N 119.923 -1.735 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.553 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.494 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -111.15 168.62 9.37 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.325 -0.86 . . . . 0.0 109.976 -179.629 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -95.2 165.17 25.06 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.558 -1.417 . . . . 0.0 109.558 179.788 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.424 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -60.8 153.55 24.17 Favored 'General case' 0 C--N 1.306 -1.319 0 O-C-N 121.094 -1.239 . . . . 0.0 110.109 -179.706 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 65.71 2.73 12.47 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.591 -1.004 . . . . 0.0 110.591 179.583 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.504 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.12 28.64 0.29 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.825 -1.397 . . . . 0.0 110.902 -179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.56 157.04 0.01 OUTLIER 'General case' 0 C--N 1.306 -1.286 0 O-C-N 120.893 -1.13 . . . . 0.0 110.358 -179.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.523 ' N ' ' O ' ' A' ' 23' ' ' GLY . 19.2 p 179.23 -174.06 0.2 Allowed 'General case' 0 C--N 1.3 -1.544 0 O-C-N 121.432 -0.793 . . . . 0.0 109.961 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.2 t -94.48 -118.52 0.1 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.248 -0.907 . . . . 0.0 109.404 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -119.86 -76.65 0.58 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.915 -1.116 . . . . 0.0 109.679 -179.744 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.573 HD23 ' CE2' ' A' ' 13' ' ' TYR . 0.1 OUTLIER -111.76 28.51 8.69 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.054 -1.029 . . . . 0.0 109.756 -179.826 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.454 ' O ' ' HB2' ' A' ' 13' ' ' TYR . 7.5 mmt -59.09 -22.65 61.15 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.295 -0.878 . . . . 0.0 109.204 179.737 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.573 ' CE2' HD23 ' A' ' 11' ' ' LEU . 4.0 m-85 62.76 56.61 1.9 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.405 -0.81 . . . . 0.0 109.845 179.745 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.428 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 75.2 m-20 -114.38 -37.94 4.21 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.175 -0.953 . . . . 0.0 109.317 179.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 28.4 m -44.1 125.03 4.2 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 109.544 -179.894 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.553 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.2 t -66.81 -10.09 44.1 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.936 -179.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.454 ' O ' ' O ' ' A' ' 18' ' ' GLY . 17.6 p -146.21 -106.65 0.1 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.275 -0.891 . . . . 0.0 109.556 -179.902 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.477 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -43.82 167.16 0.02 OUTLIER Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.534 -1.426 . . . . 0.0 109.534 -179.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.0 p -94.94 -168.85 1.88 Allowed 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.204 -1.174 . . . . 0.0 109.614 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.501 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 4.0 m -81.92 117.52 22.23 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.315 -0.865 . . . . 0.0 109.792 -179.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.27 113.44 26.11 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.129 -0.982 . . . . 0.0 109.324 179.373 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 55.81 16.35 2.01 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.686 -0.634 . . . . 0.0 109.804 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.523 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 112.18 -19.11 22.97 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.021 -1.232 . . . . 0.0 110.021 179.523 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.537 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 15.1 mtpp -93.48 151.92 19.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.099 -1.236 . . . . 0.0 109.637 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -73.32 168.04 20.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.256 -0.903 . . . . 0.0 109.55 179.991 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.339 0 O-C-N 119.95 -1.719 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.57 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.5 p . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.354 0.597 . . . . 0.0 109.614 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.538 ' HA ' ' CE ' ' A' ' 2' ' ' LYS . 0.4 OUTLIER -90.48 -169.4 2.39 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.301 -0.874 . . . . 0.0 109.688 -179.908 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.534 ' O ' ' CB ' ' A' ' 6' ' ' ALA . . . -121.18 153.2 16.67 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.01 -1.636 . . . . 0.0 109.01 179.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.425 ' O ' ' N ' ' A' ' 6' ' ' ALA . 1.2 ttmt -48.84 152.77 0.95 Allowed 'General case' 0 C--N 1.304 -1.386 0 O-C-N 120.935 -1.332 . . . . 0.0 109.958 -179.646 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 45.95 18.03 0.23 Allowed Glycine 0 N--CA 1.494 2.509 0 N-CA-C 110.615 -0.994 . . . . 0.0 110.615 -179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 3' ' ' GLY . . . -81.36 26.17 0.47 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.96 -1.318 . . . . 0.0 110.715 179.753 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 55.77 157.9 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.383 0 O-C-N 121.042 -1.036 . . . . 0.0 110.284 -179.535 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.445 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 15.5 p -179.48 -157.64 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.352 -0.842 . . . . 0.0 110.115 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -116.85 -89.27 0.58 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.402 -0.811 . . . . 0.0 109.739 -179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.505 ' NH1' ' HG2' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -141.41 -118.72 0.11 Allowed 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.421 -0.799 . . . . 0.0 109.861 -179.726 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.686 HD22 ' N ' ' A' ' 11' ' ' LEU . 3.8 mm? -79.01 52.9 1.33 Allowed 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.737 -1.227 . . . . 0.0 110.02 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 2.7 mmm -75.78 -13.14 60.29 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.134 -0.979 . . . . 0.0 109.003 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 23.8 m-85 53.32 47.02 25.17 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.393 -0.817 . . . . 0.0 109.968 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.423 ' O ' ' C ' ' A' ' 15' ' ' CYS . 12.7 t0 -110.87 -30.04 7.7 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.233 -0.917 . . . . 0.0 109.235 179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 19' ' ' SER . 74.4 m -43.58 124.19 3.44 Favored 'General case' 0 N--CA 1.49 1.556 0 CA-C-O 122.093 0.949 . . . . 0.0 109.404 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.57 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.77 -22.99 66.02 Favored 'General case' 0 C--N 1.292 -1.924 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.898 -179.574 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.778 HG23 ' O ' ' A' ' 17' ' ' THR . 10.4 t -153.96 54.5 0.71 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.152 -0.967 . . . . 0.0 109.746 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 167.39 -147.51 11.86 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.499 ' O ' ' N ' ' A' ' 26' ' ' NH2 . 28.3 t -146.26 -162.8 1.6 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.337 -1.096 . . . . 0.0 109.526 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.0 m -94.43 105.3 17.26 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.212 -0.93 . . . . 0.0 109.744 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 22' ' ' SER . 0.7 OUTLIER -119.38 131.89 55.75 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.203 -0.935 . . . . 0.0 109.061 179.665 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.407 ' HB3' ' O ' ' A' ' 21' ' ' ARG . 22.7 t 62.5 14.82 7.32 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.323 -0.861 . . . . 0.0 109.322 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.441 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.16 -23.87 34.29 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.555 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 13.2 mtmm -100.55 170.16 8.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.21 -1.171 . . . . 0.0 109.934 -179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.37 167.16 15.16 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.279 -0.888 . . . . 0.0 109.549 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.499 ' N ' ' O ' ' A' ' 19' ' ' SER . . . . . . . . 0 C--N 1.302 -1.48 0 O-C-N 120.066 -1.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.562 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.3 p . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.388 0.613 . . . . 0.0 109.492 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.51 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 2.7 mptp? -84.84 -174.97 5.56 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.231 -0.918 . . . . 0.0 109.843 -179.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -122.21 169.56 14.91 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.193 -1.563 . . . . 0.0 109.193 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.495 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 1.7 mtpt -57.21 150.75 17.03 Favored 'General case' 0 C--N 1.305 -1.328 0 O-C-N 121.103 -1.233 . . . . 0.0 109.959 -179.781 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.36 -4.87 38.96 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.507 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.9 25.96 0.35 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.245 . . . . 0.0 110.951 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.62 157.59 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.285 0 O-C-N 120.941 -1.099 . . . . 0.0 110.884 179.835 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.0 p -179.9 -157.47 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.438 -0.789 . . . . 0.0 109.789 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.511 ' HB2' ' HG3' ' A' ' 12' ' ' MET . 0.3 OUTLIER -116.78 -82.79 0.63 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.222 -0.924 . . . . 0.0 109.548 -179.962 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.527 ' NH1' ' HG3' ' A' ' 10' ' ' ARG . 1.0 OUTLIER -156.96 -66.65 0.1 Allowed 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.428 -0.795 . . . . 0.0 109.902 -179.742 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.428 HD12 ' HB3' ' A' ' 10' ' ' ARG . 2.3 mp -107.51 24.58 12.67 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.094 -1.004 . . . . 0.0 109.955 -179.471 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.511 ' HG3' ' HB2' ' A' ' 9' ' ' SER . 0.0 OUTLIER -57.25 -26.64 61.09 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.171 -0.956 . . . . 0.0 108.9 179.536 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 49.32 33.44 5.31 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.495 -0.753 . . . . 0.0 110.073 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -96.52 -24.56 16.01 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.122 -0.986 . . . . 0.0 108.924 179.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 18.1 m -51.84 125.07 14.1 Favored 'General case' 0 N--CA 1.487 1.413 0 CA-C-O 122.19 0.995 . . . . 0.0 109.568 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.562 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.4 t -67.0 -12.56 60.21 Favored 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.646 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.6 p -106.07 -122.23 0.23 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.219 -0.926 . . . . 0.0 109.745 -179.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -71.21 -129.58 0.08 OUTLIER Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.4 t -120.85 -171.68 2.24 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.276 -1.132 . . . . 0.0 109.7 -179.697 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.429 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 1.8 m -63.22 155.24 28.91 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.393 -0.817 . . . . 0.0 109.684 -179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.413 ' N ' ' O ' ' A' ' 24' ' ' LYS . 60.3 ttt180 -146.08 124.46 12.33 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.333 -0.855 . . . . 0.0 109.334 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 17.1 m 52.1 24.61 2.79 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.247 -0.908 . . . . 0.0 109.846 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.452 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 98.13 -24.24 32.69 Favored Glycine 0 N--CA 1.493 2.478 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.764 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.56 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 21.3 mttt -93.95 177.39 6.0 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.048 -1.266 . . . . 0.0 109.544 -179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.495 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -73.3 -176.89 2.35 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.296 -0.878 . . . . 0.0 109.579 -179.972 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.305 -1.364 0 O-C-N 119.9 -1.75 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.567 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 121.294 0.568 . . . . 0.0 109.543 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -113.68 168.53 9.69 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.274 -0.891 . . . . 0.0 109.552 -179.714 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -105.41 154.35 17.14 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.073 -1.611 . . . . 0.0 109.073 179.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.493 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 0.8 OUTLIER -55.33 155.42 5.13 Favored 'General case' 0 C--N 1.306 -1.288 0 O-C-N 120.967 -1.313 . . . . 0.0 109.748 -179.765 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.5 -13.32 11.86 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 110.666 -0.974 . . . . 0.0 110.666 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.524 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.16 37.74 0.33 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 120.82 -1.4 . . . . 0.0 111.097 -179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 1.5 mttp 50.57 167.94 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 O-C-N 121.119 -0.988 . . . . 0.0 110.525 179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.471 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 13.5 p 179.17 -175.54 0.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.245 -0.909 . . . . 0.0 110.076 179.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.484 ' O ' ' HD3' ' A' ' 10' ' ' ARG . 2.9 m -105.26 -103.74 0.32 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.355 -0.84 . . . . 0.0 109.514 179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.484 ' HD3' ' O ' ' A' ' 9' ' ' SER . 3.2 mmt180 -128.26 -106.99 0.3 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.038 -1.039 . . . . 0.0 109.592 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -94.55 70.01 3.57 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 120.736 -1.228 . . . . 0.0 109.606 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.513 ' O ' ' CB ' ' A' ' 13' ' ' TYR . 19.2 mmt -97.66 -31.71 12.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.25 -0.906 . . . . 0.0 109.547 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.513 ' CB ' ' O ' ' A' ' 12' ' ' MET . 3.1 m-85 77.56 40.91 0.15 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.348 -0.845 . . . . 0.0 109.5 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.468 ' OD2' ' HB2' ' A' ' 12' ' ' MET . 2.9 m-20 -96.48 -25.47 15.65 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.133 -0.979 . . . . 0.0 109.236 179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 33.2 m -55.54 127.03 27.81 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.218 -0.926 . . . . 0.0 109.776 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.567 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 3.6 t -65.76 -30.58 71.26 Favored 'General case' 0 C--N 1.296 -1.725 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.542 -179.354 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.412 ' CG2' ' C ' ' A' ' 16' ' ' CYS . 1.2 p -150.55 37.49 0.67 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 120.972 -1.08 . . . . 0.0 110.003 -179.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -164.94 -155.52 8.52 Favored Glycine 0 N--CA 1.492 2.41 0 N-CA-C 109.911 -1.276 . . . . 0.0 109.911 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.1 p -147.93 167.91 23.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.35 -1.088 . . . . 0.0 109.047 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 1.6 m -56.03 125.06 19.93 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.105 -0.997 . . . . 0.0 109.215 179.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 41.0 ttt180 -121.2 100.22 6.93 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.173 -0.954 . . . . 0.0 109.689 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 68.98 2.21 3.48 Favored 'General case' 0 C--N 1.294 -1.835 0 O-C-N 121.84 -0.538 . . . . 0.0 110.316 179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.458 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 137.74 -30.24 2.59 Favored Glycine 0 N--CA 1.493 2.442 0 C-N-CA 119.587 -1.292 . . . . 0.0 110.48 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.7 OUTLIER -102.73 177.31 4.89 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.995 -1.297 . . . . 0.0 109.998 -179.698 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.493 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -74.56 168.51 19.63 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 119.492 -0.883 . . . . 0.0 109.421 179.637 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.448 0 O-C-N 119.939 -1.726 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.561 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.8 p . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.396 0.617 . . . . 0.0 109.609 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.0 OUTLIER -104.61 165.09 11.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.259 -0.901 . . . . 0.0 109.759 -179.775 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -102.43 165.0 16.66 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.595 -1.402 . . . . 0.0 109.595 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.42 ' HA ' ' HB3' ' A' ' 25' ' ' CYS . 8.3 mtpp -59.96 150.08 30.01 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.123 -1.222 . . . . 0.0 110.389 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.471 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 57.14 9.05 3.76 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 110.839 -0.904 . . . . 0.0 110.839 179.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.511 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -80.77 27.68 0.37 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.727 -1.454 . . . . 0.0 110.647 179.736 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER 54.72 154.46 0.01 OUTLIER 'General case' 0 C--N 1.31 -1.138 0 O-C-N 121.039 -1.038 . . . . 0.0 110.894 -179.89 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.446 ' HB3' ' O ' ' A' ' 7' ' ' LYS . 14.9 p -178.71 -158.19 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.273 -0.892 . . . . 0.0 110.274 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 61.8 p -98.0 -131.81 0.21 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.366 -0.834 . . . . 0.0 109.496 -179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' O ' HD12 ' A' ' 11' ' ' LEU . 65.9 mtm180 -134.63 -0.5 2.88 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.786 -1.196 . . . . 0.0 110.382 -179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' O ' ' A' ' 10' ' ' ARG . 0.2 OUTLIER -174.44 35.12 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.785 -1.197 . . . . 0.0 110.566 179.84 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.445 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -91.22 -19.57 22.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.17 -0.956 . . . . 0.0 108.793 179.25 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 12' ' ' MET . 16.1 m-85 61.61 57.92 2.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.468 -0.77 . . . . 0.0 110.253 179.567 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.445 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 0.8 OUTLIER -106.82 -11.05 15.86 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.224 -0.922 . . . . 0.0 109.014 179.329 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.514 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 72.8 m -57.82 125.76 24.45 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 122.05 0.929 . . . . 0.0 110.026 179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.561 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.9 t -57.96 -33.01 68.39 Favored 'General case' 0 C--N 1.295 -1.782 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.967 179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 4.5 t -143.27 -22.03 0.62 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.06 -1.025 . . . . 0.0 111.276 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . -101.69 -148.33 21.2 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 109.991 -1.243 . . . . 0.0 109.991 -179.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 26' ' ' NH2 . 66.1 p -140.25 -174.17 3.87 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.426 -1.044 . . . . 0.0 108.994 179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 1.4 m -91.78 96.18 10.28 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.02 -1.05 . . . . 0.0 109.395 -179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -131.47 143.78 50.67 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.273 -0.892 . . . . 0.0 109.408 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . 0.415 ' HB3' ' HE2' ' A' ' 24' ' ' LYS . 0.2 OUTLIER 65.2 28.61 12.06 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.284 -0.885 . . . . 0.0 109.578 -180.0 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 69.99 11.65 67.04 Favored Glycine 0 N--CA 1.494 2.543 0 N-CA-C 109.819 -1.312 . . . . 0.0 109.819 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.59 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.2 mtmm -140.83 173.3 11.62 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.199 -1.177 . . . . 0.0 109.281 179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.42 ' HB3' ' HA ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -73.32 165.33 25.26 Favored 'General case' 0 C--N 1.295 -1.769 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.101 179.806 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.509 ' N ' ' O ' ' A' ' 19' ' ' SER . . . . . . . . 0 C--N 1.299 -1.605 0 O-C-N 120.063 -1.648 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.54 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 121.269 0.556 . . . . 0.0 109.515 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.527 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 11.7 mmtt -95.11 -172.4 2.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.387 -0.821 . . . . 0.0 109.962 -179.51 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.439 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -139.73 157.54 25.28 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.242 -1.543 . . . . 0.0 109.242 179.787 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -43.65 152.05 0.17 Allowed 'General case' 0 N--CA 1.486 1.338 0 O-C-N 121.294 -1.121 . . . . 0.0 109.699 -179.856 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 91.18 -30.27 6.45 Favored Glycine 0 N--CA 1.485 1.955 0 N-CA-C 108.245 -1.942 . . . . 0.0 108.245 -179.055 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.487 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.07 76.19 3.63 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 121.459 -1.024 . . . . 0.0 108.533 179.248 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -33.47 153.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 121.177 0.513 . . . . 0.0 110.222 -179.652 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.46 ' SG ' ' O ' ' A' ' 23' ' ' GLY . 24.6 p -144.28 -160.48 1.13 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.071 -1.018 . . . . 0.0 109.518 -179.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -93.02 -83.7 0.31 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.127 -0.983 . . . . 0.0 109.459 -179.789 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' NH1' ' CG ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -175.18 105.82 0.09 Allowed 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.469 -0.77 . . . . 0.0 109.64 -179.975 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.413 ' CB ' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER 70.06 44.33 0.8 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.328 -0.858 . . . . 0.0 109.899 179.807 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.464 ' HB3' ' OD1' ' A' ' 14' ' ' ASP . 13.5 mmm -90.52 -15.61 30.41 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.082 -1.011 . . . . 0.0 109.0 179.467 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 55.62 59.29 3.94 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.491 -0.755 . . . . 0.0 109.726 179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.464 ' OD1' ' HB3' ' A' ' 12' ' ' MET . 5.1 m-20 -124.21 -30.18 3.48 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.194 -0.941 . . . . 0.0 109.523 179.78 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 12.2 m -49.56 125.0 10.46 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 122.066 0.936 . . . . 0.0 109.348 -179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.54 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.5 t -66.77 -14.65 62.85 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.125 -179.558 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 3.9 t -119.71 31.73 6.41 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.085 -1.009 . . . . 0.0 109.862 -179.705 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.467 ' O ' ' HB2' ' A' ' 15' ' ' CYS . . . 141.98 -150.89 22.42 Favored Glycine 0 N--CA 1.49 2.255 0 N-CA-C 109.746 -1.342 . . . . 0.0 109.746 179.771 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.414 ' O ' ' C ' ' A' ' 20' ' ' CYS . 7.5 p -124.16 175.88 6.74 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.364 -1.08 . . . . 0.0 109.288 179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.414 ' C ' ' O ' ' A' ' 19' ' ' SER . 16.8 m -44.58 147.11 0.63 Allowed 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.205 -0.934 . . . . 0.0 109.62 -179.955 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' A' ' 24' ' ' LYS . 19.1 ttt180 -123.6 100.8 6.98 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.386 -0.822 . . . . 0.0 108.841 179.377 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.4 p 59.89 12.89 3.29 Favored 'General case' 0 C--N 1.292 -1.903 0 O-C-N 121.801 -0.562 . . . . 0.0 110.045 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.46 ' O ' ' SG ' ' A' ' 8' ' ' CYS . . . 127.92 -37.71 2.25 Favored Glycine 0 N--CA 1.493 2.457 0 C-N-CA 119.803 -1.189 . . . . 0.0 110.241 179.67 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.625 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -103.07 162.59 12.82 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.1 -1.235 . . . . 0.0 109.86 -179.509 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -67.16 165.32 16.24 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.823 -1.173 . . . . 0.0 109.012 179.799 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.53 0 O-C-N 120.173 -1.579 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.55 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.49 1.559 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -116.36 -167.49 1.29 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.195 -0.94 . . . . 0.0 110.332 -179.015 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -138.02 161.46 25.54 Favored Glycine 0 N--CA 1.491 2.364 0 N-CA-C 108.815 -1.714 . . . . 0.0 108.815 179.451 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.479 ' HA ' ' C ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -59.53 152.78 21.12 Favored 'General case' 0 C--N 1.306 -1.31 0 O-C-N 120.785 -1.421 . . . . 0.0 109.37 -179.754 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 95.58 -34.73 4.68 Favored Glycine 0 N--CA 1.486 1.975 0 N-CA-C 107.311 -2.316 . . . . 0.0 107.311 -178.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.535 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -77.39 83.33 3.83 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 178.67 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -29.57 152.47 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 CA-C-O 121.361 0.6 . . . . 0.0 110.527 -179.549 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -156.95 -156.18 0.59 Allowed 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.02 -1.05 . . . . 0.0 109.848 -179.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 1.3 t -93.73 -137.29 0.2 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.281 -0.887 . . . . 0.0 109.483 -179.754 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.482 ' O ' ' HB2' ' A' ' 11' ' ' LEU . 2.6 mtp180 -134.77 112.79 11.02 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 120.923 -1.11 . . . . 0.0 109.191 -179.87 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 2.6 mp 63.64 65.96 0.71 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.618 -0.676 . . . . 0.0 109.564 -179.788 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.466 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -116.68 -16.62 10.68 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.417 -0.802 . . . . 0.0 109.23 179.828 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 12' ' ' MET . 18.0 m-85 66.26 43.84 2.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.33 -0.856 . . . . 0.0 109.889 179.774 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.466 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 11.8 m-20 -110.83 -34.04 6.36 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.179 -0.951 . . . . 0.0 109.465 179.69 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 27.2 m -52.45 124.22 12.91 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.142 -0.974 . . . . 0.0 109.207 179.918 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.55 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.34 -24.28 66.5 Favored 'General case' 0 C--N 1.292 -1.914 0 CA-C-N 115.871 -0.604 . . . . 0.0 109.656 -179.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -137.99 83.75 2.0 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.305 -0.872 . . . . 0.0 109.491 179.903 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 121.88 -154.76 16.71 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.551 -1.42 . . . . 0.0 109.551 179.938 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 17.9 t -147.44 158.0 43.8 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.245 -1.15 . . . . 0.0 109.488 179.828 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LYS . 19.7 m -45.75 103.21 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.36 -0.837 . . . . 0.0 109.382 -179.971 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 24' ' ' LYS . 38.9 ttp180 -111.9 136.04 51.72 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.093 -1.004 . . . . 0.0 109.453 179.911 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 60.21 14.3 4.46 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.222 -0.924 . . . . 0.0 109.368 -179.93 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 101.31 -23.49 35.1 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.926 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.608 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 0.4 OUTLIER -104.65 176.38 5.18 Favored 'General case' 0 N--CA 1.487 1.39 0 O-C-N 121.172 -1.193 . . . . 0.0 109.798 -179.914 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.479 ' C ' ' HA ' ' A' ' 4' ' ' LYS . 0.6 OUTLIER -73.06 170.33 15.11 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.326 -0.95 . . . . 0.0 109.004 179.792 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.302 -1.493 0 O-C-N 120.083 -1.636 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.558 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 0.1 OUTLIER -106.07 173.85 6.14 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.218 -0.926 . . . . 0.0 109.655 -179.851 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . 0.454 ' O ' ' C ' ' A' ' 4' ' ' LYS . . . -122.81 155.95 17.21 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.997 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.505 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 2.0 ttmt -41.88 150.82 0.11 Allowed 'General case' 0 N--CA 1.485 1.291 0 O-C-N 121.283 -1.128 . . . . 0.0 109.815 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 92.77 -31.47 6.17 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 108.064 -2.015 . . . . 0.0 108.064 -179.105 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.512 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -71.98 75.83 0.92 Allowed 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.554 -0.968 . . . . 0.0 108.563 179.08 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.1 OUTLIER -31.38 152.48 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 CA-C-O 121.223 0.535 . . . . 0.0 110.346 -179.625 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 26.1 p -148.63 -168.27 3.05 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.017 -1.052 . . . . 0.0 110.09 -179.164 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.62 -88.97 0.22 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.489 -0.757 . . . . 0.0 109.773 -179.916 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.682 ' C ' HD22 ' A' ' 11' ' ' LEU . 0.0 OUTLIER -148.52 -74.74 0.18 Allowed 'General case' 0 C--N 1.297 -1.701 0 O-C-N 121.505 -0.747 . . . . 0.0 109.528 -179.585 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.682 HD22 ' C ' ' A' ' 10' ' ' ARG . 3.6 mm? -108.87 33.74 4.07 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.199 -0.938 . . . . 0.0 109.718 -179.807 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.417 ' HB3' ' OD2' ' A' ' 14' ' ' ASP . 0.0 OUTLIER -66.23 -20.6 66.17 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.148 -0.97 . . . . 0.0 109.336 179.853 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 57.2 65.92 1.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.333 -0.854 . . . . 0.0 109.703 179.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 12' ' ' MET . 0.7 OUTLIER -127.77 -32.35 2.36 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.213 -0.929 . . . . 0.0 109.612 179.87 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 6.6 m -56.67 126.9 28.83 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.211 -0.931 . . . . 0.0 109.259 179.837 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.558 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.0 t -66.37 -33.92 76.8 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.235 0.54 . . . . 0.0 109.583 -179.687 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -114.67 130.82 56.86 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.276 -0.89 . . . . 0.0 109.354 179.791 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 58.72 -166.41 7.44 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.431 -1.467 . . . . 0.0 109.431 -179.916 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.408 ' O ' ' C ' ' A' ' 20' ' ' CYS . 0.0 OUTLIER -120.41 179.65 4.24 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.226 -1.161 . . . . 0.0 109.482 179.996 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.408 ' C ' ' O ' ' A' ' 19' ' ' SER . 10.3 m -43.76 130.2 5.55 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.352 -0.843 . . . . 0.0 109.258 179.904 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -127.91 123.09 34.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.195 -0.941 . . . . 0.0 109.29 179.913 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 62.71 24.4 14.53 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.242 -179.853 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.65 -19.65 39.62 Favored Glycine 0 N--CA 1.49 2.245 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.617 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 5.1 mttm -109.26 171.9 7.16 Favored 'General case' 0 N--CA 1.486 1.356 0 O-C-N 121.108 -1.231 . . . . 0.0 109.346 -179.867 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.505 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 1.3 m -73.06 164.87 26.05 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 119.309 -0.957 . . . . 0.0 109.031 179.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.303 -1.444 0 O-C-N 120.042 -1.662 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.517 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.387 0.613 . . . . 0.0 109.544 . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 16' ' ' CYS . 23.8 mmtt -88.74 -178.8 5.86 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.1 -1.0 . . . . 0.0 109.877 -179.523 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -135.3 169.43 23.39 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.082 -1.607 . . . . 0.0 109.082 179.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 6.6 mtpp -47.3 148.92 1.14 Allowed 'General case' 0 C--N 1.306 -1.302 0 O-C-N 120.924 -1.339 . . . . 0.0 109.615 -179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.402 ' O ' ' N ' ' A' ' 7' ' ' LYS . . . 93.21 -33.18 5.23 Favored Glycine 0 N--CA 1.486 2.002 0 N-CA-C 107.831 -2.107 . . . . 0.0 107.831 -178.946 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.498 ' O ' ' C ' ' A' ' 7' ' ' LYS . . . -70.38 75.25 0.54 Allowed 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.049 -1.093 . . . . 0.0 108.049 178.756 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 4.0 ptmt -31.76 151.09 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.5 0 CA-C-O 121.451 0.643 . . . . 0.0 110.249 -179.079 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.06 -164.24 1.65 Allowed 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.17 -0.956 . . . . 0.0 109.542 -179.246 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.522 ' OG ' ' N ' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -94.06 -164.76 1.21 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 109.233 179.99 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.558 ' HG2' ' NH1' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -75.72 -25.5 56.67 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.085 -1.01 . . . . 0.0 109.177 179.727 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.529 HD23 ' CE1' ' A' ' 13' ' ' TYR . 0.2 OUTLIER -156.63 91.05 1.2 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.212 -0.93 . . . . 0.0 109.393 179.75 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.534 ' C ' ' CD2' ' A' ' 13' ' ' TYR . 0.8 OUTLIER -114.98 -15.02 11.82 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.245 -0.909 . . . . 0.0 109.295 -179.866 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.534 ' CD2' ' C ' ' A' ' 12' ' ' MET . 1.5 m-85 55.79 30.66 16.14 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.299 -0.875 . . . . 0.0 109.591 -179.875 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . 0.446 ' CG ' ' HB3' ' A' ' 12' ' ' MET . 3.3 p30 -101.86 -31.15 10.86 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.166 -0.959 . . . . 0.0 109.345 179.749 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 7.0 m -54.67 124.5 16.56 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.108 -0.995 . . . . 0.0 108.918 179.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.517 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 2.8 t -66.29 -30.87 71.38 Favored 'General case' 0 C--N 1.292 -1.928 0 CA-C-O 121.354 0.597 . . . . 0.0 109.484 -179.786 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 1.1 p -130.96 128.06 39.68 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.306 -0.872 . . . . 0.0 109.393 179.906 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.45 -151.75 34.91 Favored Glycine 0 N--CA 1.492 2.412 0 N-CA-C 109.519 -1.432 . . . . 0.0 109.519 179.969 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -140.38 -157.67 0.79 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.237 -1.155 . . . . 0.0 109.621 -179.963 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.463 ' SG ' ' O ' ' A' ' 9' ' ' SER . 21.8 m -86.09 96.7 9.96 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.399 -0.813 . . . . 0.0 109.529 -179.926 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' N ' ' O ' ' A' ' 24' ' ' LYS . 24.8 ttp180 -95.04 139.35 31.53 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.046 -1.034 . . . . 0.0 109.786 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 6.9 m 53.63 20.63 2.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.252 -0.905 . . . . 0.0 109.524 179.892 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 88.83 -0.01 81.92 Favored Glycine 0 N--CA 1.489 2.215 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 -179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 3.9 mtmm -118.52 164.91 14.59 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 121.139 -1.212 . . . . 0.0 109.882 -179.706 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.1 m -70.21 164.91 23.27 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.299 -0.96 . . . . 0.0 108.782 179.597 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.514 0 O-C-N 119.829 -1.794 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.591 ' HB2' ' CA ' ' A' ' 16' ' ' CYS . 1.6 p . . . . . 0 N--CA 1.49 1.552 0 CA-C-O 121.42 0.629 . . . . 0.0 109.691 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.557 ' N ' ' HD2' ' A' ' 2' ' ' LYS . 0.2 OUTLIER -82.52 162.68 21.93 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.334 -0.854 . . . . 0.0 109.668 -179.953 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -101.66 160.08 18.19 Favored Glycine 0 N--CA 1.489 2.206 0 N-CA-C 108.964 -1.655 . . . . 0.0 108.964 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.499 ' HG2' ' O ' ' A' ' 25' ' ' CYS . 0.2 OUTLIER -50.98 146.78 5.71 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.161 -1.199 . . . . 0.0 110.715 -179.401 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.476 ' HA2' ' HB3' ' A' ' 24' ' ' LYS . . . 71.51 -10.92 3.43 Favored Glycine 0 N--CA 1.495 2.615 0 N-CA-C 111.586 -0.606 . . . . 0.0 111.586 179.136 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.544 ' O ' ' O ' ' A' ' 7' ' ' LYS . . . -79.67 36.69 0.33 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 120.576 -1.543 . . . . 0.0 111.392 -179.074 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 24' ' ' LYS . 0.0 OUTLIER 51.67 161.19 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.122 -0.987 . . . . 0.0 110.988 179.731 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.513 ' N ' ' O ' ' A' ' 23' ' ' GLY . 24.4 p 179.05 -167.0 0.07 Allowed 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.237 -0.914 . . . . 0.0 109.665 179.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.55 ' CB ' ' HB2' ' A' ' 12' ' ' MET . 0.3 OUTLIER -93.73 -161.8 0.88 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.426 -0.797 . . . . 0.0 109.234 -179.95 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.481 ' C ' HD12 ' A' ' 11' ' ' LEU . 0.2 OUTLIER -91.74 -32.58 15.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.031 -1.043 . . . . 0.0 108.9 179.911 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.481 HD12 ' C ' ' A' ' 10' ' ' ARG . 1.2 mp -153.18 22.37 0.56 Allowed 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 179.655 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' MET . . . . . 0.55 ' HB2' ' CB ' ' A' ' 9' ' ' SER . 57.2 tpp -62.56 -17.74 60.61 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.995 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 12' ' ' MET . 8.3 m-85 63.27 49.03 3.4 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.471 -0.768 . . . . 0.0 110.344 179.649 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -99.75 -21.31 15.83 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.172 -0.955 . . . . 0.0 108.548 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . . . . . . . . . 46.2 m -56.23 125.59 22.45 Favored 'General case' 0 N--CA 1.486 1.353 0 CA-C-O 122.038 0.923 . . . . 0.0 109.264 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.591 ' CA ' ' HB2' ' A' ' 1' ' ' CYS . 1.8 t -66.1 -34.89 79.1 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.947 -0.57 . . . . 0.0 109.595 -179.759 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.77 ' O ' HG23 ' A' ' 17' ' ' THR . 9.7 t -154.56 89.89 1.29 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.35 -0.844 . . . . 0.0 109.346 179.596 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 151.85 -149.77 21.54 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.419 -1.472 . . . . 0.0 109.419 -179.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 3.1 m -139.31 178.33 7.27 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.165 -1.197 . . . . 0.0 109.458 179.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . 0.45 ' SG ' ' O ' ' A' ' 9' ' ' SER . 1.8 m -95.68 106.92 19.09 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.283 -0.885 . . . . 0.0 109.729 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 3.0 ttp180 -118.06 135.84 53.93 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.266 -0.896 . . . . 0.0 109.484 179.881 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 51.26 28.81 4.45 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.323 -0.86 . . . . 0.0 109.681 179.949 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.513 ' O ' ' N ' ' A' ' 8' ' ' CYS . . . 80.02 -5.98 60.84 Favored Glycine 0 N--CA 1.493 2.444 0 N-CA-C 109.504 -1.438 . . . . 0.0 109.504 -179.624 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.624 ' HA ' ' HA ' ' A' ' 7' ' ' LYS . 17.7 mttm -100.55 146.15 27.46 Favored 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.329 -1.1 . . . . 0.0 109.156 179.962 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 0.8 OUTLIER -71.96 172.53 9.83 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.163 -0.961 . . . . 0.0 109.146 -179.832 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' NH2 . . . . . 0.449 ' N ' ' HG2' ' A' ' 4' ' ' LYS . . . . . . . . 0 C--N 1.305 -1.368 0 O-C-N 119.911 -1.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_