data_2ait_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 2ait _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.468 ' CG ' ' HD2' ' A' ' 7' ' ' PRO . 4.7 tt0 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 110.322 -0.251 . . . . 3.7400000000000002 110.322 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.468 ' HD2' ' CG ' ' A' ' 6' ' ' GLU . 18.3 Cg_endo -74.99 144.8 30.71 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.507 1.793 . . . . 0.95999999999999996 111.008 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.18 173.21 0.75 Allowed Pre-proline 0 C--N 1.326 -0.428 0 O-C-N 124.509 1.131 . . . . 1.6399999999999999 109.325 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.403 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 18.2 Cg_endo -74.99 172.13 16.96 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.526 1.803 . . . . 1.1299999999999999 111.004 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.51 11.16 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 2.79 110.037 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 26' ' ' GLY . 7.9 p -108.29 20.75 18.25 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.533 1.146 . . . . 0.97999999999999998 108.261 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.442 ' CG1' ' O ' ' A' ' 24' ' ' ASP . 43.9 t -138.28 131.46 40.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.565 1.166 . . . . 2.1600000000000001 109.27 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' LEU . 1.1 m -97.92 167.02 11.17 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.498 1.124 . . . . 3.4300000000000002 110.389 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.495 ' CD1' HD22 ' A' ' 70' ' ' LEU . 14.7 tp -123.76 130.91 53.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 1.8600000000000001 109.267 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -115.67 70.14 0.74 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 1.125 . . . . 1.8100000000000001 110.985 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.643 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.9 tt0 -91.92 102.19 14.76 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.493 1.121 . . . . 1.5700000000000001 110.284 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' CA ' ' A' ' 59' ' ' GLY . 10.5 p -106.68 -152.92 0.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 2.3799999999999999 110.007 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.515 ' O ' ' CD1' ' A' ' 61' ' ' ILE . 55.7 p-90 -93.35 -27.54 16.71 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.496 1.122 . . . . 3.04 107.981 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -77.2 -61.64 1.92 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 7.2000000000000002 110.337 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 2.6 p90 -159.25 177.09 11.4 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.125 . . . . 8.7799999999999994 110.998 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.77 132.97 52.13 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.544 1.153 . . . . 2.98 110.036 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.564 HE21 ' N ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -120.65 142.9 49.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 3.5899999999999999 110.286 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.564 ' N ' HE21 ' A' ' 22' ' ' GLN . . . -112.7 123.75 51.0 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.509 1.131 . . . . 2.1099999999999999 109.259 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.442 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 39.6 t0 -107.47 126.15 52.15 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.469 1.106 . . . . 2.3100000000000001 109.332 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.474 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 56.5 t-20 -94.04 89.67 6.12 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.543 1.152 . . . . 0.75 109.309 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -81.27 8.34 58.35 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.525 1.14 . . . . 1.02 110.981 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -179.99 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.301 -1.0 . . . . 1.8 108.301 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.444 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -115.49 21.25 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 2.1000000000000001 109.294 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.424 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 6.5 mt-10 -154.02 137.99 16.34 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.464 1.102 . . . . 2.1299999999999999 110.301 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.8 m -51.72 130.3 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.533 1.146 . . . . 1.7 110.455 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -140.29 153.65 22.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 2.3199999999999998 109.287 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.435 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 54.8 m -113.15 133.13 55.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.56 1.163 . . . . 2.21 110.397 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.4 m -135.24 179.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 2.0699999999999998 109.275 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 13.6 pttm -159.7 108.88 1.81 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.544 1.152 . . . . 3.4100000000000001 109.253 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.543 ' CG2' ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.59 114.59 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 1.47 109.311 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 68' ' ' ARG . 19.4 t -97.33 121.18 47.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 1.8700000000000001 109.289 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 67' ' ' ALA . 70.4 m-85 -78.89 178.62 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.489 1.118 . . . . 1.9099999999999999 111.021 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.48 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 0.4 OUTLIER -84.61 -9.77 57.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.487 1.117 . . . . 3.2000000000000002 110.273 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.488 ' HB2' ' CG2' ' A' ' 41' ' ' THR . 0.0 OUTLIER -81.59 0.93 36.12 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.546 1.154 . . . . 2.0800000000000001 109.299 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.488 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 81.52 31.0 0.13 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.15 . . . . 3.6800000000000002 109.317 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.488 ' CG2' ' HB2' ' A' ' 39' ' ' ASP . 0.2 OUTLIER -124.44 174.28 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 3.25 110.392 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 36' ' ' VAL . 1.7 mp0 -135.84 151.24 49.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.511 1.132 . . . . 2.6800000000000002 110.3 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.601 ' O ' ' CE2' ' A' ' 46' ' ' TYR . . . -87.78 46.51 3.45 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 124.55 1.156 . . . . 3.2400000000000002 111.019 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.98 154.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 0.754 . . . . 3.2999999999999998 109.301 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.435 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.8 OUTLIER -91.1 123.07 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 2.04 108.298 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CE2' ' O ' ' A' ' 43' ' ' GLY . 25.8 m-85 -124.93 137.59 54.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.48 1.112 . . . . 2.8799999999999999 110.971 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.85 130.21 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.117 . . . . 1.78 109.277 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.474 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 40.6 t -126.81 138.02 56.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 2.1000000000000001 109.285 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -81.07 172.9 8.65 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 2.3999999999999999 109.291 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.444 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.3 Cg_endo -75.08 99.32 1.24 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.522 1.801 . . . . 0.87 110.979 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.3 30.13 3.22 Favored Glycine 0 CA--C 1.53 1.001 0 O-C-N 124.496 1.122 . . . . 1.1499999999999999 110.982 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.453 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 34.4 tt0 -125.49 153.29 43.78 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.465 0.744 . . . . 3.4199999999999999 110.327 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.453 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -139.33 120.77 15.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.51 1.131 . . . . 2.2200000000000002 109.333 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.545 ' N ' HE22 ' A' ' 22' ' ' GLN . 0.7 OUTLIER -143.04 154.66 44.2 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.094 . . . . 2.54 110.415 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.563 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -61.88 146.68 49.05 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.526 1.142 . . . . 1.8200000000000001 110.398 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.502 ' CG1' ' CB ' ' A' ' 23' ' ' ALA . 29.2 m -139.33 11.12 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.52 1.137 . . . . 2.5699999999999998 109.293 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 170.38 -169.58 42.39 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.457 1.098 . . . . 2.3799999999999999 110.947 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.437 ' C ' ' HA ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -104.42 -170.73 1.81 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.471 0.748 . . . . 5.8499999999999996 109.299 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.427 ' CA ' ' O ' ' A' ' 17' ' ' SER . . . -88.27 175.05 44.2 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.507 1.129 . . . . 2.2400000000000002 110.969 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' ND1' ' A' ' 66' ' ' HIS . 0.6 OUTLIER -94.2 36.04 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.474 0.75 . . . . 3.3100000000000001 111.022 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.515 ' CD1' ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 3.7000000000000002 109.283 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.994 0 N-CA-C 111.017 -0.833 . . . . 1.3700000000000001 111.017 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.427 ' ND1' ' HB2' ' A' ' 60' ' ' TYR . 5.3 m-70 -125.15 116.28 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 0.765 . . . . 1.47 109.598 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.643 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -40.6 118.63 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.528 1.142 . . . . 1.8200000000000001 109.312 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -78.01 -45.39 23.85 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 7.0 110.269 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 68' ' ' ARG . 5.2 p90 177.21 166.94 0.58 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 2.52 111.002 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.543 ' CD2' ' CG2' ' A' ' 35' ' ' VAL . 10.9 mt -85.06 136.46 33.56 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.548 1.155 . . . . 2.4300000000000002 109.319 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' GLU . . . -116.6 138.05 51.72 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.542 1.151 . . . . 1.5800000000000001 109.309 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -81.29 147.19 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.474 1.109 . . . . 4.5099999999999998 110.306 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 O-C-N 124.484 1.115 . . . . 2.5099999999999998 108.292 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 110.299 -0.26 . . . . 3.2599999999999998 110.299 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.99 149.41 36.71 Favored 'Trans proline' 0 C--N 1.36 1.136 0 O-C-N 124.49 1.784 . . . . 1.3100000000000001 110.954 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.401 ' HB1' ' C ' ' A' ' 70' ' ' LEU . . . -84.77 166.56 31.42 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.133 . . . . 1.9199999999999999 109.316 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HD3' ' CD ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 173.01 15.26 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.473 1.775 . . . . 1.0900000000000001 110.977 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.1 9.74 29.7 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.539 1.149 . . . . 4.1900000000000004 110.0 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 9' ' ' PRO . 11.8 p -91.05 -36.8 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 2.0899999999999999 108.312 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 84.5 t -79.08 115.51 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 1.8600000000000001 109.29 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.414 ' OG1' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -83.59 158.12 22.04 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.499 1.124 . . . . 2.3399999999999999 110.404 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.482 HD12 ' CG2' ' A' ' 35' ' ' VAL . 11.4 tp -113.13 112.22 23.44 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.48 1.113 . . . . 2.02 109.292 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.484 ' HB3' ' CB ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -96.19 59.22 1.9 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.518 1.136 . . . . 2.9900000000000002 110.963 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.436 ' NE2' ' HB3' ' A' ' 60' ' ' TYR . 6.1 tt0 -78.23 117.83 19.87 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.467 1.104 . . . . 2.0499999999999998 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.55 ' OG ' ' O ' ' A' ' 20' ' ' TYR . 6.4 p -107.88 -149.36 0.43 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.557 1.16 . . . . 1.6899999999999999 110.001 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.653 ' CE3' ' N ' ' A' ' 19' ' ' ARG . 24.3 p-90 -106.68 -42.81 4.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.499 1.124 . . . . 2.6200000000000001 108.03 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.653 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -78.31 -33.25 49.42 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 9.2300000000000004 110.339 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.65 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER -167.4 160.08 13.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.136 . . . . 8.9600000000000009 110.979 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.503 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 5.6 m -112.22 144.22 41.99 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.511 1.132 . . . . 3.4399999999999999 110.003 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.536 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 1.7 tt0 -126.77 172.75 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.12 . . . . 2.3100000000000001 110.307 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.41 125.15 22.4 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.56 1.163 . . . . 1.96 109.273 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.414 ' OD1' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -97.89 137.34 36.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 2.5 109.264 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.48 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 34.9 t-20 -95.69 81.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.78000000000000003 109.252 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.84 20.52 27.93 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.502 1.126 . . . . 1.1599999999999999 110.989 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' O ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -94.05 10.11 34.95 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.28 -1.007 . . . . 3.0099999999999998 108.28 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.466 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.88 32.68 0.11 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.448 1.092 . . . . 3.2599999999999998 109.327 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.4 OUTLIER -163.03 138.68 6.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.52 1.138 . . . . 2.54 110.299 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -54.62 118.95 4.61 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 1.99 110.423 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -143.88 173.4 5.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.485 1.116 . . . . 1.72 109.281 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.0 m -124.56 141.97 51.69 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 1.49 110.424 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.91 175.34 5.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.092 . . . . 1.98 109.275 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HG2' ' CB ' ' A' ' 71' ' ' ALA . 16.0 ptmt -156.6 112.01 2.9 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 4.0300000000000002 109.309 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.482 ' CG2' HD12 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -56.48 132.4 20.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 1.6399999999999999 109.26 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.537 HG13 ' CZ ' ' A' ' 69' ' ' TYR . 78.6 t -116.96 118.64 59.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 2.21 109.328 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -76.44 166.33 23.57 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.505 1.128 . . . . 1.9399999999999999 111.018 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.485 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.91 -9.77 32.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.53 1.144 . . . . 3.0899999999999999 110.312 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -90.47 19.09 5.51 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.142 . . . . 2.6600000000000001 109.344 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.72 13.72 5.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.471 1.107 . . . . 4.2300000000000004 109.291 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.31 161.94 14.2 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.139 . . . . 2.04 110.401 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -135.52 146.08 47.71 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 2.8100000000000001 110.334 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.487 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -73.14 -92.63 0.11 Allowed Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.475 1.109 . . . . 1.8400000000000001 110.967 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.487 ' CD2' ' O ' ' A' ' 43' ' ' GLY . 42.4 mt -153.31 144.45 23.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.446 0.733 . . . . 2.4100000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.9 m -75.75 105.5 6.82 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.566 1.166 . . . . 2.2799999999999998 108.327 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -112.97 142.12 46.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.518 1.136 . . . . 3.0499999999999998 110.979 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.22 122.8 40.65 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.471 1.107 . . . . 1.74 109.31 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.48 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 74.8 t -113.71 140.68 32.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.513 1.133 . . . . 1.5900000000000001 109.281 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.471 ' O ' ' ND2' ' A' ' 25' ' ' ASN . . . -80.8 177.54 2.93 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 1.49 109.314 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.466 ' HB3' ' C ' ' A' ' 28' ' ' ALA . 18.4 Cg_endo -74.99 108.49 2.73 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.486 1.782 . . . . 1.1699999999999999 111.002 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.66 6.41 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.441 1.088 . . . . 0.73999999999999999 111.027 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.466 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 12.1 tt0 -134.98 157.84 45.88 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.462 0.742 . . . . 2.4500000000000002 110.34 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.466 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -130.22 137.22 56.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.523 1.139 . . . . 2.1400000000000001 109.286 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.42 ' C ' ' HG2' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -143.68 143.64 31.52 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 1.6100000000000001 110.445 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.2 OUTLIER -69.2 131.96 45.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.489 1.118 . . . . 1.9199999999999999 110.422 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.475 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 12.2 m -119.09 -10.13 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.476 1.11 . . . . 2.0499999999999998 109.253 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -171.41 -172.88 37.94 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.501 1.125 . . . . 2.4199999999999999 111.026 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.503 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.5 m-20 -90.11 -166.32 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.504 0.767 . . . . 6.2699999999999996 109.279 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -86.56 170.47 42.38 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.5 1.125 . . . . 2.52 111.021 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.566 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -92.6 40.99 1.06 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.517 0.775 . . . . 3.5899999999999999 111.012 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.53 ' CD1' ' O ' ' A' ' 18' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.496 0 O-C-N 124.461 1.101 . . . . 3.77 109.324 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.049 0 N-CA-C 110.998 -0.841 . . . . 1.3400000000000001 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.516 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.0 OUTLIER -124.52 119.16 28.32 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.541 0.789 . . . . 1.52 109.56 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -45.2 108.79 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.491 1.119 . . . . 1.8999999999999999 109.316 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -77.51 -31.2 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.489 1.118 . . . . 5.25 110.314 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CZ ' HG13 ' A' ' 36' ' ' VAL . 15.7 p90 -173.93 175.69 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.503 1.127 . . . . 2.0299999999999998 110.973 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.465 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 51.7 mt -106.41 140.2 39.7 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.466 1.104 . . . . 2.3999999999999999 109.294 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.495 ' CB ' ' HG2' ' A' ' 34' ' ' LYS . . . -107.78 142.79 37.27 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.538 1.149 . . . . 1.77 109.342 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -87.63 139.92 30.05 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 4.9400000000000004 110.279 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 2.75 108.3 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 110.29 -0.263 . . . . 3.9900000000000002 110.29 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 142.65 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.517 1.798 . . . . 0.62 111.03 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.32 158.48 56.69 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.499 1.125 . . . . 1.8799999999999999 109.3 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 171.36 18.47 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.472 1.775 . . . . 0.89000000000000001 110.969 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -85.41 9.13 16.49 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.491 1.12 . . . . 2.5299999999999998 109.982 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.8 p -104.74 23.19 13.81 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.509 1.131 . . . . 1.01 108.298 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 84.7 t -146.03 116.02 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.461 1.1 . . . . 1.8 109.303 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.435 ' N ' ' O ' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -81.24 161.81 23.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 2.02 110.44 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.471 ' CD1' HG22 ' A' ' 35' ' ' VAL . 16.1 tp -118.63 106.08 12.25 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.481 1.113 . . . . 1.79 109.292 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -87.24 61.72 6.85 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.475 1.109 . . . . 2.52 110.98 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.552 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 35.4 tt0 -78.24 96.84 5.34 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.572 1.17 . . . . 1.6899999999999999 110.327 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.34 -163.0 0.93 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 3.6000000000000001 109.996 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.577 ' CZ3' ' HB3' ' A' ' 19' ' ' ARG . 66.1 p-90 -99.14 -49.79 4.37 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.479 1.112 . . . . 3.2400000000000002 108.045 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.577 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.03 -21.11 59.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 7.9500000000000002 110.284 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' CB ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -166.87 175.51 7.68 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.577 1.173 . . . . 5.9699999999999998 110.976 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 58' ' ' ASP . 6.0 m -141.58 138.5 32.69 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 3.7000000000000002 109.968 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -137.66 -179.97 6.07 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.57 1.169 . . . . 2.98 110.284 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.425 ' CB ' HD12 ' A' ' 70' ' ' LEU . . . -134.03 129.95 36.83 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 1.8200000000000001 109.33 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.475 ' N ' ' OD1' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.12 136.25 35.67 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.555 1.16 . . . . 4.6299999999999999 109.301 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.447 ' HB3' ' O ' ' A' ' 49' ' ' ALA . 60.0 t-20 -96.49 87.22 4.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.093 . . . . 0.54000000000000004 109.301 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.44 13.04 53.58 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.526 1.141 . . . . 0.56999999999999995 110.985 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.2 -155.64 0.33 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.328 -0.99 . . . . 1.6000000000000001 108.328 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.59 20.98 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.117 . . . . 1.9299999999999999 109.313 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.408 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -155.95 152.26 27.99 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 3.1099999999999999 110.29 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.1 m -65.8 125.64 25.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 1.98 110.353 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.24 159.52 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.424 1.077 . . . . 1.6299999999999999 109.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.466 HG23 ' CB ' ' A' ' 73' ' ' CYS . 67.1 m -114.58 143.71 44.56 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 1.6200000000000001 110.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 3.4 m -141.09 177.84 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 1.97 109.285 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.96 105.53 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 2.79 109.291 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.488 ' O ' ' CG1' ' A' ' 35' ' ' VAL . 0.4 OUTLIER -53.7 116.01 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 1.6200000000000001 109.3 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 68' ' ' ARG . 23.2 t -99.39 120.36 48.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.461 1.101 . . . . 1.9199999999999999 109.292 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.434 ' OH ' ' N ' ' A' ' 58' ' ' ASP . 96.4 m-85 -83.94 167.92 16.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 1.7 110.939 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.501 ' CG ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -58.47 -21.5 51.76 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.472 1.108 . . . . 3.98 110.286 179.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -79.82 3.56 19.24 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.533 1.146 . . . . 2.29 109.313 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 75.22 3.06 4.02 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.485 1.116 . . . . 4.2199999999999998 109.281 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.406 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.4 p -78.73 144.94 34.78 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.492 1.12 . . . . 2.1699999999999999 110.404 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.416 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 0.4 OUTLIER -121.36 142.38 50.04 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.497 1.123 . . . . 2.48 110.299 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.494 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -60.88 -106.65 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.484 1.115 . . . . 1.8300000000000001 110.961 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.494 ' CD2' ' O ' ' A' ' 43' ' ' GLY . 47.2 mt -153.02 140.15 19.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 0.773 . . . . 2.1899999999999999 109.304 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.8 m -42.8 101.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 1.106 . . . . 2.0800000000000001 108.298 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 2.6 m-85 -108.98 111.91 23.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.46 1.1 . . . . 3.2999999999999998 111.031 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.83 128.84 35.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.52 1.138 . . . . 1.9199999999999999 109.332 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 69.6 t -128.79 140.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.465 1.103 . . . . 1.54 109.356 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -80.51 171.77 11.5 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.515 1.134 . . . . 1.8600000000000001 109.292 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.408 ' HB3' ' N ' ' A' ' 29' ' ' GLU . 18.5 Cg_endo -74.97 102.52 1.6 Allowed 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.475 1.776 . . . . 0.73999999999999999 111.044 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 105.13 36.55 2.89 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.507 1.129 . . . . 0.66000000000000003 110.989 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.94 158.27 43.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.545 0.791 . . . . 2.2400000000000002 110.291 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.407 HG21 ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -126.68 141.75 45.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.444 1.09 . . . . 2.21 109.326 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.444 ' C ' ' HB3' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -146.45 141.31 27.0 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.476 1.11 . . . . 1.3200000000000001 110.376 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.2 OUTLIER -59.58 141.5 54.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 1.9199999999999999 110.408 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 15.3 m -129.59 1.21 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 2.3700000000000001 109.311 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 21' ' ' SER . . . 164.37 -173.48 40.34 Favored Glycine 0 CA--C 1.529 0.962 0 O-C-N 124.55 1.156 . . . . 2.2999999999999998 111.048 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.441 ' O ' ' OG ' ' A' ' 21' ' ' SER . 7.9 m-20 -92.61 -173.58 3.4 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 0.777 . . . . 5.8700000000000001 109.305 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -83.68 -176.78 51.44 Favored Glycine 0 CA--C 1.53 0.98 0 O-C-N 124.551 1.157 . . . . 2.2000000000000002 111.03 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.566 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 3.9 p90 -101.13 27.95 5.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.501 0.765 . . . . 3.6200000000000001 111.016 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 18' ' ' TRP . 1.3 pp . . . . . 0 C--N 1.325 -0.478 0 O-C-N 124.512 1.132 . . . . 3.9100000000000001 109.317 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 N-CA-C 111.004 -0.838 . . . . 1.5 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.566 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 10.6 m170 -107.93 107.0 17.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 0.764 . . . . 3.5 109.589 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.552 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -39.66 113.18 0.31 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.493 1.12 . . . . 1.48 109.28 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -78.14 -38.34 43.95 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.119 . . . . 6.9100000000000001 110.317 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.502 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 18.1 p90 179.53 -166.12 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.492 1.12 . . . . 1.8799999999999999 111.02 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.483 HD22 ' CG2' ' A' ' 35' ' ' VAL . 70.9 mt -115.24 138.24 51.16 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.527 1.142 . . . . 2.3399999999999999 109.32 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.42 139.4 50.48 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.499 1.124 . . . . 1.73 109.291 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.8 147.3 51.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.536 1.147 . . . . 4.1100000000000003 110.344 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.466 ' CB ' HG23 ' A' ' 32' ' ' THR . 40.7 t . . . . . 0 C--N 1.325 -0.494 0 O-C-N 124.461 1.101 . . . . 2.6600000000000001 108.307 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.419 ' CG ' ' HB2' ' A' ' 72' ' ' ARG . 43.1 tp10 . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 110.282 -0.266 . . . . 3.48 110.282 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 139.6 24.46 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.524 1.802 . . . . 0.75 110.998 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.41 ' HA ' ' CG ' ' A' ' 72' ' ' ARG . . . -57.29 168.45 0.95 Allowed Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 1.6299999999999999 109.313 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 170.0 21.39 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.518 1.799 . . . . 0.96999999999999997 111.004 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.54 13.31 12.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 2.9500000000000002 110.024 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.2 p -112.65 21.46 15.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.492 1.12 . . . . 0.95999999999999996 108.294 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.1 t -139.5 123.04 18.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 2.0 109.28 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.4 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -91.49 154.31 19.21 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.436 1.085 . . . . 2.04 110.409 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.493 HD12 ' CG2' ' A' ' 35' ' ' VAL . 6.1 tp -108.07 111.96 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 1.8100000000000001 109.319 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -93.23 58.06 2.8 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 2.3599999999999999 110.97 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.643 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.1 tt0 -74.48 98.43 3.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.52 1.138 . . . . 1.8200000000000001 110.311 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.448 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 0.9 OUTLIER -92.6 -160.84 0.78 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.483 1.115 . . . . 1.8999999999999999 109.998 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.642 ' O ' ' CD1' ' A' ' 61' ' ' ILE . 29.8 p-90 -99.5 -46.48 5.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 3.3199999999999998 107.97 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -71.67 -34.24 69.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 6.4800000000000004 110.307 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.589 ' CD2' HG23 ' A' ' 55' ' ' THR . 0.1 OUTLIER -167.45 157.29 10.62 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.138 . . . . 6.6100000000000003 111.005 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 2.8 t -105.94 134.96 48.23 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 2.8399999999999999 110.01 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.584 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 9.5 mt-30 -125.74 172.15 10.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 2.0800000000000001 110.259 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.476 ' HB3' ' CG1' ' A' ' 56' ' ' VAL . . . -134.76 129.23 34.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.523 1.14 . . . . 1.6299999999999999 109.301 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 25' ' ' ASN . 2.8 t0 -102.65 133.46 47.62 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 2.2000000000000002 109.288 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.463 ' HB3' ' O ' ' A' ' 49' ' ' ALA . 60.8 t-20 -93.67 93.77 8.21 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.489 1.118 . . . . 0.53000000000000003 109.262 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.51 9.6 70.23 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.519 1.137 . . . . 0.60999999999999999 110.993 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.55 -167.71 1.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 1.6399999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.422 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -125.2 25.44 7.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.576 1.173 . . . . 2.3999999999999999 109.3 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.411 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 10.3 mt-10 -158.09 144.82 17.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.502 1.126 . . . . 2.2999999999999998 110.28 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.0 m -61.78 128.89 38.41 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.454 1.096 . . . . 1.6699999999999999 110.359 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.21 162.25 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.497 1.123 . . . . 1.49 109.282 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.446 ' CG2' ' HB2' ' A' ' 73' ' ' CYS . 49.0 m -111.94 143.61 42.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.469 1.106 . . . . 1.52 110.405 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -140.71 177.94 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.453 1.096 . . . . 1.9099999999999999 109.318 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -160.67 110.48 1.73 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.55 1.156 . . . . 3.3199999999999998 109.329 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.504 ' O ' ' CG1' ' A' ' 35' ' ' VAL . 0.4 OUTLIER -61.88 114.35 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.46 1.1 . . . . 1.49 109.273 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.551 ' O ' ' N ' ' A' ' 68' ' ' ARG . 84.7 t -96.05 117.62 40.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.502 1.126 . . . . 1.6000000000000001 109.286 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.498 ' OH ' ' N ' ' A' ' 58' ' ' ASP . 25.2 m-85 -75.45 173.47 10.92 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 3.1800000000000002 111.048 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.431 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 1.8 mm-40 -81.16 -12.06 59.3 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.462 1.102 . . . . 3.6400000000000001 110.255 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.457 ' CG ' ' OG1' ' A' ' 41' ' ' THR . 5.2 p-10 -93.73 34.0 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.102 . . . . 2.6499999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 46.96 67.38 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.133 . . . . 4.2599999999999998 109.306 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.457 ' OG1' ' CG ' ' A' ' 39' ' ' ASP . 1.0 OUTLIER -152.29 152.16 31.81 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.463 1.102 . . . . 1.9199999999999999 110.357 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.477 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 7.9 mt-10 -130.9 139.58 50.11 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 2.0499999999999998 110.313 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.488 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -58.95 -103.94 0.01 OUTLIER Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.537 1.148 . . . . 1.72 110.996 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.601 ' O ' ' CD2' ' A' ' 46' ' ' TYR . 45.1 mt -153.6 139.66 18.3 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 2.4700000000000002 109.319 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.7 m -51.53 103.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.496 1.123 . . . . 1.8200000000000001 108.328 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 33.2 m-85 -112.05 122.87 48.96 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 2.7599999999999998 111.017 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.67 123.77 38.3 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.493 1.121 . . . . 1.5700000000000001 109.301 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.449 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 68.2 t -122.36 138.34 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.499 1.124 . . . . 1.6000000000000001 109.318 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -80.93 173.51 7.61 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.52 1.137 . . . . 1.4399999999999999 109.35 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.422 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.2 Cg_endo -74.99 97.74 1.1 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.487 1.783 . . . . 0.73999999999999999 111.0 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 109.9 35.27 2.22 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.507 1.13 . . . . 0.80000000000000004 110.967 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -140.05 159.48 42.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.511 0.771 . . . . 3.54 110.289 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -128.82 140.27 49.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 O-C-N 124.496 1.122 . . . . 2.04 109.284 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.444 ' C ' ' HG2' ' A' ' 22' ' ' GLN . 0.6 OUTLIER -148.05 147.76 29.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.556 1.16 . . . . 1.4399999999999999 110.418 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.589 HG23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -60.94 146.15 47.83 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.508 1.13 . . . . 1.6799999999999999 110.427 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.479 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 29.5 m -132.64 -0.54 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.479 1.112 . . . . 2.6600000000000001 109.332 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 162.52 -169.46 37.8 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.519 1.137 . . . . 2.25 111.014 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.51 ' O ' ' CB ' ' A' ' 21' ' ' SER . 4.4 m-20 -89.67 -164.63 1.18 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.513 0.773 . . . . 5.6699999999999999 109.309 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -86.53 -169.06 45.54 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.514 1.134 . . . . 2.0 111.007 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.684 ' CD2' HG21 ' A' ' 61' ' ' ILE . 18.5 p90 -90.86 -7.09 53.23 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.537 0.786 . . . . 2.5600000000000001 110.975 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.684 HG21 ' CD2' ' A' ' 60' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.552 1.158 . . . . 4.0800000000000001 109.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.016 0 N-CA-C 111.011 -0.836 . . . . 1.0 111.011 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.583 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -118.82 131.29 56.09 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.535 0.785 . . . . 1.47 109.644 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.643 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -46.33 122.59 4.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 1.47 109.309 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -77.9 -47.38 18.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.575 1.172 . . . . 6.4500000000000002 110.287 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CE2' ' HD2' ' A' ' 68' ' ' ARG . 6.2 p90 -174.85 -177.5 1.13 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.496 1.123 . . . . 2.0499999999999998 110.988 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.487 HD22 ' CD1' ' A' ' 14' ' ' LEU . 7.9 mt -105.69 135.05 47.8 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.551 1.157 . . . . 2.6099999999999999 109.28 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.19 148.52 45.71 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.507 1.129 . . . . 1.76 109.295 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.419 ' HB2' ' CG ' ' A' ' 6' ' ' GLU . 3.6 mtt180 -81.3 154.49 26.51 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.511 1.132 . . . . 5.2699999999999996 110.301 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.446 ' HB2' ' CG2' ' A' ' 32' ' ' THR . 38.1 t . . . . . 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.124 . . . . 2.6299999999999999 108.324 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 110.311 -0.255 . . . . 3.0699999999999998 110.311 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 148.88 35.75 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.552 1.817 . . . . 0.84999999999999998 110.978 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -76.07 150.35 83.21 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.109 . . . . 1.97 109.325 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.425 ' HD3' ' NE ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 -176.1 2.71 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.435 1.755 . . . . 1.95 110.985 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.52 6.34 20.81 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.456 1.098 . . . . 2.6099999999999999 109.988 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 26' ' ' GLY . 2.0 p -96.42 20.09 11.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.533 1.146 . . . . 1.1399999999999999 108.327 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 70.0 t -149.47 121.83 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.517 1.135 . . . . 1.97 109.257 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.409 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.47 136.75 36.54 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.531 1.145 . . . . 2.1000000000000001 110.385 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.466 HD12 ' CG2' ' A' ' 35' ' ' VAL . 32.5 tp -89.98 105.53 17.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.545 1.153 . . . . 1.8400000000000001 109.311 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.545 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -96.44 65.44 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.446 1.091 . . . . 2.02 110.958 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.446 ' OE1' ' CB ' ' A' ' 67' ' ' ALA . 17.4 tt0 -77.2 120.63 22.53 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 1.99 110.278 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.592 ' O ' ' CD2' ' A' ' 60' ' ' TYR . 6.4 p -87.77 -144.22 0.13 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.476 1.11 . . . . 1.95 109.976 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.638 ' CE3' ' HB3' ' A' ' 19' ' ' ARG . 32.4 p-90 -101.74 -54.76 2.66 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.497 1.123 . . . . 2.6099999999999999 108.012 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.638 ' HB3' ' CE3' ' A' ' 18' ' ' TRP . 2.8 ptt180 -107.67 14.75 25.32 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.489 1.118 . . . . 6.2300000000000004 110.299 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.616 ' CD1' ' HA2' ' A' ' 57' ' ' GLY . 0.2 OUTLIER -168.24 176.26 6.05 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.502 1.126 . . . . 5.8899999999999997 110.99 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.488 ' OG ' ' N ' ' A' ' 58' ' ' ASP . 5.1 p -143.61 159.73 41.93 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.496 1.122 . . . . 3.04 110.022 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.545 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 3.2 mt-30 -141.26 135.92 31.12 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.49 1.118 . . . . 2.21 110.333 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.457 ' CB ' HG23 ' A' ' 33' ' ' VAL . . . -100.51 117.87 35.55 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.47 1.106 . . . . 1.9099999999999999 109.258 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 24' ' ' ASP . 2.2 t0 -98.22 113.7 25.72 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.502 1.126 . . . . 2.7200000000000002 109.272 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.526 ' HB3' ' O ' ' A' ' 49' ' ' ALA . 58.5 t-20 -78.16 102.19 7.42 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.524 1.14 . . . . 0.64000000000000001 109.249 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.7 3.52 81.38 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.452 1.095 . . . . 0.75 110.985 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.13 -161.76 0.58 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.342 -0.985 . . . . 1.45 108.342 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.463 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -130.5 21.22 5.15 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 2.6600000000000001 109.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.428 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -153.31 147.55 25.75 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.469 1.106 . . . . 3.4300000000000002 110.357 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.8 m -59.47 127.87 34.21 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.492 1.12 . . . . 1.9399999999999999 110.392 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.557 HG22 HH12 ' A' ' 72' ' ' ARG . 15.9 m -141.87 154.06 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.513 1.133 . . . . 1.78 109.329 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.428 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 1.8 m -101.73 141.19 34.97 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.524 1.14 . . . . 1.8200000000000001 110.425 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.457 HG23 ' CB ' ' A' ' 23' ' ' ALA . 1.8 m -129.93 170.69 18.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.445 1.091 . . . . 2.1400000000000001 109.345 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 2.0 ptmt -160.64 89.46 0.82 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.504 1.128 . . . . 3.3100000000000001 109.289 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.524 ' CG1' ' CG ' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -40.03 139.01 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 1.8100000000000001 109.35 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 68' ' ' ARG . 75.0 t -118.03 117.29 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.531 1.144 . . . . 2.04 109.282 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.422 ' OH ' ' OD1' ' A' ' 58' ' ' ASP . 78.4 m-85 -73.64 166.55 23.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 1.9099999999999999 110.984 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -5.59 33.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.505 1.128 . . . . 3.27 110.297 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.4 9.4 31.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.424 1.077 . . . . 2.6200000000000001 109.337 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.459 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 78.52 -1.25 2.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.479 1.112 . . . . 3.9300000000000002 109.293 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.2 p -83.2 167.63 17.54 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.539 1.149 . . . . 2.3399999999999999 110.395 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 36' ' ' VAL . 16.3 mt-10 -134.54 170.28 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.475 1.109 . . . . 2.1699999999999999 110.306 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -83.83 -115.57 0.63 Allowed Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.554 1.159 . . . . 2.0 111.017 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.425 ' O ' ' CD2' ' A' ' 46' ' ' TYR . 36.1 mt -148.44 147.58 29.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.501 0.766 . . . . 2.6800000000000002 109.299 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.428 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.4 OUTLIER -47.2 120.33 3.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 1.112 . . . . 2.1299999999999999 108.285 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.671 ' CD2' ' CG1' ' A' ' 56' ' ' VAL . 6.1 m-85 -137.22 108.05 6.65 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.141 . . . . 2.6600000000000001 110.973 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.27 134.61 34.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 1.5600000000000001 109.255 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.476 ' CG2' ' HB ' ' A' ' 54' ' ' THR . 49.7 t -133.11 141.74 43.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.448 1.092 . . . . 1.52 109.302 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -80.78 167.08 35.13 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.474 1.109 . . . . 1.77 109.291 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.463 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.1 Cg_endo -75.09 117.98 5.08 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.514 1.797 . . . . 0.95999999999999996 110.954 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.6 28.76 18.25 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.492 1.12 . . . . 1.02 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.442 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -132.16 167.18 20.21 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.483 0.755 . . . . 2.4500000000000002 110.297 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -135.75 125.11 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 1.97 109.284 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.476 ' HB ' ' CG2' ' A' ' 48' ' ' VAL . 0.4 OUTLIER -125.78 137.23 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.124 . . . . 1.97 110.381 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 6.1 m -82.03 127.65 33.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.487 1.117 . . . . 2.1600000000000001 110.431 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.671 ' CG1' ' CD2' ' A' ' 46' ' ' TYR . 3.6 m -95.83 -51.97 10.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.522 1.138 . . . . 3.21 109.36 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.616 ' HA2' ' CD1' ' A' ' 20' ' ' TYR . . . 119.63 89.6 1.2 Allowed Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.517 1.136 . . . . 3.1099999999999999 110.993 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.524 ' CG ' ' CG1' ' A' ' 35' ' ' VAL . 7.7 m-20 -170.24 126.32 0.79 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.508 0.77 . . . . 6.1799999999999997 109.354 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -131.76 162.27 23.8 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.494 1.121 . . . . 2.1600000000000001 110.993 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.717 ' CD1' HG21 ' A' ' 61' ' ' ILE . 42.6 p90 -95.54 -6.94 39.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 0.762 . . . . 2.46 111.023 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.717 HG21 ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.454 0 O-C-N 124.484 1.115 . . . . 3.1099999999999999 109.269 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.021 0 N-CA-C 110.978 -0.849 . . . . 1.03 110.978 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.579 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -116.45 165.08 13.63 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.507 0.769 . . . . 1.4299999999999999 109.575 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.446 ' CB ' ' OE1' ' A' ' 16' ' ' GLN . . . -83.01 121.6 27.22 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.561 1.163 . . . . 1.8400000000000001 109.321 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -75.74 -46.3 31.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.419 1.075 . . . . 5.1600000000000001 110.273 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 17.9 p90 178.92 161.74 0.72 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.494 1.121 . . . . 2.79 111.002 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.469 ' O ' ' N ' ' A' ' 8' ' ' ALA . 17.4 mt -81.57 139.96 34.76 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.5 1.125 . . . . 2.5099999999999998 109.311 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.481 ' CB ' ' HG2' ' A' ' 34' ' ' LYS . . . -117.22 132.06 56.72 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.482 1.114 . . . . 1.8700000000000001 109.319 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.557 HH12 HG22 ' A' ' 31' ' ' VAL . 3.9 mmt180 -63.5 144.87 56.62 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 6.8899999999999997 110.295 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.9 t . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.547 1.155 . . . . 2.73 108.276 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 110.278 -0.267 . . . . 4.3399999999999999 110.278 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 134.73 18.24 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.524 1.802 . . . . 0.78000000000000003 111.024 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.37 166.75 2.04 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.496 1.122 . . . . 1.6000000000000001 109.322 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.622 ' HB3' HH21 ' A' ' 72' ' ' ARG . 18.3 Cg_endo -75.05 176.1 10.37 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.509 1.794 . . . . 0.90000000000000002 111.027 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 t -92.2 13.99 17.52 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.479 1.112 . . . . 3.5499999999999998 110.0 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 7.4 p -99.94 -18.23 17.18 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.5 1.125 . . . . 1.1599999999999999 108.29 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.449 ' CG1' HD11 ' A' ' 70' ' ' LEU . 1.4 t -97.77 117.9 43.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.548 1.155 . . . . 2.5600000000000001 109.303 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.421 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -86.98 139.55 30.48 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.461 1.101 . . . . 2.1499999999999999 110.39 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.513 ' CD1' HD22 ' A' ' 70' ' ' LEU . 10.3 tp -96.86 114.12 25.72 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 2.02 109.283 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.8 OUTLIER -106.97 70.37 0.8 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 1.77 111.002 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.717 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 24.9 tt0 -78.6 127.8 32.62 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 1.55 110.317 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.596 ' O ' ' CE2' ' A' ' 60' ' ' TYR . 1.7 p -110.8 -151.63 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.52 1.138 . . . . 1.77 109.985 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 28.1 p-90 -97.5 -47.49 5.64 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.524 1.14 . . . . 2.4900000000000002 108.026 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -37.55 55.29 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.128 . . . . 6.9699999999999998 110.278 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.547 ' C ' ' O ' ' A' ' 58' ' ' ASP . 6.4 p90 -166.22 -177.06 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.561 1.163 . . . . 7.7199999999999998 110.981 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.508 ' O ' ' CG2' ' A' ' 55' ' ' THR . 27.4 t -117.97 164.07 15.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 3.6499999999999999 109.968 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -138.41 130.34 28.23 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 2.3599999999999999 110.286 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -95.1 119.37 33.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 1.6200000000000001 109.301 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD2' ' OG1' ' A' ' 13' ' ' THR . 2.1 t0 -97.68 115.59 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 2.25 109.26 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' A' ' 49' ' ' ALA . 38.3 t-20 -77.59 84.56 3.95 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.474 1.109 . . . . 0.85999999999999999 109.269 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.78 15.7 59.96 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.502 1.127 . . . . 0.69999999999999996 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.413 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -93.78 11.35 29.52 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.313 -0.995 . . . . 2.7599999999999998 108.313 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.5 32.45 0.09 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 3.2200000000000002 109.321 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.456 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.7 OUTLIER -158.01 133.72 9.07 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.555 1.159 . . . . 2.5899999999999999 110.321 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -50.23 119.33 3.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 2.2200000000000002 110.377 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.4 m -145.82 163.68 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.456 1.098 . . . . 1.6299999999999999 109.304 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.3 m -117.66 146.63 43.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.535 1.147 . . . . 1.53 110.409 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.1 m -142.31 176.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.512 1.133 . . . . 1.6699999999999999 109.308 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.452 ' CG ' ' O ' ' A' ' 71' ' ' ALA . 0.7 OUTLIER -160.19 103.56 1.45 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 3.3500000000000001 109.338 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.587 ' CG2' ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -60.44 137.03 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 1.7 109.341 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.581 ' HB ' ' CD1' ' A' ' 69' ' ' TYR . 13.0 t -116.64 124.23 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 2.4700000000000002 109.275 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.664 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 54.6 m-85 -76.26 166.71 23.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.466 1.104 . . . . 1.73 111.03 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.572 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 1.2 tt0 -61.42 -14.38 27.79 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 3.6200000000000001 110.29 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -84.87 7.93 19.23 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 1.97 109.265 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 t0 71.92 6.21 5.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.09 . . . . 3.9300000000000002 109.278 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.435 ' OG1' ' HB2' ' A' ' 37' ' ' TYR . 42.5 p -87.35 151.3 23.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 1.77 110.409 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.471 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 4.6 mt-10 -118.52 141.42 48.58 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.512 1.132 . . . . 1.9399999999999999 110.338 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.499 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -65.89 -94.54 0.03 OUTLIER Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.475 1.109 . . . . 1.77 111.0 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.499 ' CD2' ' O ' ' A' ' 43' ' ' GLY . 50.8 mt -153.84 139.86 18.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.554 0.797 . . . . 2.3100000000000001 109.333 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 113.91 8.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.505 1.128 . . . . 1.6299999999999999 108.324 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.03 138.47 54.44 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 1.138 . . . . 2.4300000000000002 111.019 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -96.09 115.6 27.68 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.506 1.129 . . . . 1.8999999999999999 109.318 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.525 ' CG1' ' O ' ' A' ' 52' ' ' GLN . 96.5 t -99.72 131.94 46.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 O-C-N 124.511 1.132 . . . . 1.6899999999999999 109.36 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.457 ' O ' ' ND2' ' A' ' 25' ' ' ASN . . . -68.44 171.97 5.19 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 2.3599999999999999 109.334 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.456 ' HB3' ' N ' ' A' ' 29' ' ' GLU . 18.3 Cg_endo -74.99 111.54 3.35 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.5 1.789 . . . . 1.6799999999999999 110.981 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.33 21.58 44.31 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.52 1.137 . . . . 0.78000000000000003 111.016 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.525 ' O ' ' CG1' ' A' ' 48' ' ' VAL . 0.3 OUTLIER -123.03 155.27 37.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.514 0.773 . . . . 3.6200000000000001 110.268 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.472 ' N ' ' CD ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -122.36 129.49 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.529 1.143 . . . . 2.5099999999999998 109.328 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.439 ' HB ' ' CG2' ' A' ' 48' ' ' VAL . 0.3 OUTLIER -126.92 138.6 53.32 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.459 1.099 . . . . 1.55 110.425 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.534 ' CG2' ' CD1' ' A' ' 20' ' ' TYR . 2.0 m -78.41 139.48 38.75 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 1.71 110.347 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -113.51 -50.49 5.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.548 1.155 . . . . 2.4300000000000002 109.291 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.42 ' O ' HG12 ' A' ' 35' ' ' VAL . . . 132.53 123.14 2.41 Favored Glycine 0 CA--C 1.531 1.037 0 O-C-N 124.471 1.107 . . . . 2.8999999999999999 110.962 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.664 ' OD1' ' CE2' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 165.78 127.13 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.536 0.786 . . . . 7.0300000000000002 109.278 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -147.52 123.42 1.73 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.51 1.131 . . . . 2.4399999999999999 110.983 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB2' ' CE1' ' A' ' 66' ' ' HIS . 15.2 p90 -70.39 1.87 4.52 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.48 0.753 . . . . 2.98 111.008 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.511 ' CG2' ' O ' ' A' ' 18' ' ' TRP . 9.6 tt . . . . . 0 C--N 1.325 -0.477 0 O-C-N 124.461 1.101 . . . . 5.6900000000000004 109.316 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.972 0 N-CA-C 111.002 -0.839 . . . . 1.1899999999999999 111.002 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 60' ' ' TYR . 1.7 m170 -120.53 135.73 54.99 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.482 0.754 . . . . 1.76 109.611 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.717 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -36.73 134.59 0.48 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 1.6899999999999999 109.329 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.572 ' CD ' ' HA ' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -91.49 -47.24 7.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.473 1.108 . . . . 5.6600000000000001 110.269 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.581 ' CD1' ' HB ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -178.11 173.95 1.42 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 3.3799999999999999 110.993 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.587 ' CD2' ' CG2' ' A' ' 35' ' ' VAL . 4.5 mt -96.85 144.78 26.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.486 1.117 . . . . 2.5499999999999998 109.249 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.452 ' O ' ' CG ' ' A' ' 34' ' ' LYS . . . -125.94 129.58 49.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.494 1.121 . . . . 1.6299999999999999 109.289 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.622 HH21 ' HB3' ' A' ' 9' ' ' PRO . 4.5 ptp180 -85.57 141.74 29.63 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.53 1.144 . . . . 4.6399999999999997 110.316 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 2.1899999999999999 108.305 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 110.238 -0.282 . . . . 3.0 110.238 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 138.37 22.88 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.512 1.796 . . . . 0.80000000000000004 110.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.68 170.09 0.31 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 1.8799999999999999 109.309 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.448 ' HG2' ' CG2' ' A' ' 12' ' ' VAL . 18.2 Cg_endo -75.03 167.46 26.98 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.474 1.776 . . . . 1.1699999999999999 110.977 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 45.5 p -85.06 7.67 20.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.517 1.136 . . . . 3.3199999999999998 110.008 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.464 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 6.1 p -114.76 29.79 7.78 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 1.01 108.255 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.448 ' CG2' ' HG2' ' A' ' 9' ' ' PRO . 89.1 t -143.25 109.66 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.536 1.148 . . . . 1.79 109.299 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.43 153.79 29.43 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 1.76 110.436 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.48 HD12 ' CG2' ' A' ' 35' ' ' VAL . 15.1 tp -105.23 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.443 1.09 . . . . 1.9299999999999999 109.327 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -88.64 57.27 4.11 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.541 1.15 . . . . 2.4199999999999999 110.946 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.522 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 25.6 tt0 -76.26 100.71 5.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 1.6699999999999999 110.3 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.627 ' O ' ' CE1' ' A' ' 60' ' ' TYR . 1.4 p -77.79 -150.41 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.445 1.091 . . . . 1.71 109.984 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.71 ' O ' HG12 ' A' ' 61' ' ' ILE . 34.6 p-90 -98.45 -65.18 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.045 -1.094 . . . . 2.54 108.045 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.595 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -93.1 16.68 12.33 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.486 1.116 . . . . 6.96 110.329 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.612 ' CD2' ' CG2' ' A' ' 55' ' ' THR . 0.0 OUTLIER -168.71 161.62 11.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 5.3399999999999999 110.984 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.486 ' OG ' ' C ' ' A' ' 57' ' ' GLY . 65.1 p -143.28 135.6 27.16 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 3.1600000000000001 110.027 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -135.25 177.87 7.47 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.507 1.129 . . . . 2.8999999999999999 110.314 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.23 133.72 39.28 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.524 1.14 . . . . 1.8999999999999999 109.266 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.472 ' HA ' ' CG1' ' A' ' 53' ' ' ILE . 39.8 t0 -103.29 130.44 50.56 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 2.29 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.5 ' CB ' ' O ' ' A' ' 49' ' ' ALA . 23.7 t-20 -84.4 96.87 9.21 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.444 1.09 . . . . 0.80000000000000004 109.285 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -86.47 2.01 87.36 Favored Glycine 0 CA--C 1.529 0.968 0 O-C-N 124.53 1.144 . . . . 0.64000000000000001 111.023 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.464 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -88.94 -157.76 0.46 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.272 -1.01 . . . . 1.6200000000000001 108.272 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.414 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -131.1 16.29 5.1 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 2.0299999999999998 109.315 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -144.14 152.15 40.53 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.562 1.164 . . . . 2.9900000000000002 110.285 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 90.7 m -71.48 130.8 42.19 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.528 1.143 . . . . 1.9199999999999999 110.392 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.8 m -141.46 164.0 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.467 1.105 . . . . 2.0899999999999999 109.294 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.415 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 74.9 m -113.25 141.44 46.99 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 1.6899999999999999 110.415 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 1.2 m -137.74 174.17 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.468 1.105 . . . . 1.7 109.282 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 71' ' ' ALA . 5.3 pttt -155.33 105.21 2.47 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 3.1499999999999999 109.316 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.52 ' HB ' ' CG2' ' A' ' 56' ' ' VAL . 0.4 OUTLIER -58.27 115.65 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.516 1.135 . . . . 1.72 109.248 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.503 ' O ' ' N ' ' A' ' 68' ' ' ARG . 99.2 t -98.85 119.3 46.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 1.8200000000000001 109.277 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.454 ' HA ' ' HA ' ' A' ' 67' ' ' ALA . 68.7 m-85 -78.61 170.05 17.26 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 1.79 110.998 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.484 ' HG3' ' CG ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -68.05 -12.45 60.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.527 1.142 . . . . 4.46 110.297 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.3 16.62 7.13 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.504 1.128 . . . . 1.8 109.285 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.2 t0 65.22 10.68 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 3.9199999999999999 109.306 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.41 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.1 OUTLIER -83.99 155.07 22.95 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.547 1.154 . . . . 2.7000000000000002 110.381 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 13.0 mt-10 -133.33 127.07 32.75 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.485 1.116 . . . . 2.3300000000000001 110.273 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.502 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -52.29 -105.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.496 1.123 . . . . 1.79 110.989 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.598 ' O ' ' CD2' ' A' ' 46' ' ' TYR . 49.9 mt -153.23 138.06 17.09 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.442 0.731 . . . . 2.46 109.302 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.415 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.1 OUTLIER -55.05 112.08 0.98 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.529 1.143 . . . . 1.4199999999999999 108.282 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.598 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 35.2 m-85 -121.74 123.71 42.48 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.525 1.141 . . . . 2.3900000000000001 110.983 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.45 120.18 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.53 1.144 . . . . 1.5700000000000001 109.3 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.4 t -115.9 142.7 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.495 1.122 . . . . 1.6599999999999999 109.331 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.5 ' O ' ' CB ' ' A' ' 25' ' ' ASN . . . -86.31 169.47 15.18 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.554 1.159 . . . . 1.45 109.352 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.414 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.3 Cg_endo -75.0 104.84 1.97 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.517 1.798 . . . . 0.87 111.02 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.86 34.78 2.93 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.494 1.121 . . . . 0.76000000000000001 111.022 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -152.33 158.08 42.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.461 0.741 . . . . 2.3399999999999999 110.276 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 24' ' ' ASP . 8.0 mt -126.21 153.33 34.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.478 1.111 . . . . 3.8799999999999999 109.294 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.448 ' C ' ' HB3' ' A' ' 22' ' ' GLN . 0.5 OUTLIER -153.65 142.94 21.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.459 1.099 . . . . 1.8799999999999999 110.401 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.612 ' CG2' ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -62.84 142.89 58.04 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 1.8 110.391 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.52 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 4.4 m -122.92 -7.28 8.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 2.0499999999999998 109.29 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.486 ' C ' ' OG ' ' A' ' 21' ' ' SER . . . 159.48 -156.17 27.3 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.485 1.115 . . . . 2.3799999999999999 111.027 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.443 ' HA ' ' HA ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -91.65 179.0 5.76 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 0.773 . . . . 6.21 109.304 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -89.45 -145.43 12.25 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.542 1.151 . . . . 2.1699999999999999 110.959 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.627 ' CE1' ' O ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -98.46 -1.2 41.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.491 0.76 . . . . 3.52 110.968 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.71 HG12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.472 1.107 . . . . 5.0899999999999999 109.341 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.982 0 N-CA-C 111.01 -0.836 . . . . 1.3 111.01 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.529 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.8 OUTLIER -121.27 123.49 42.33 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.522 0.778 . . . . 1.3899999999999999 109.56 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.522 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -43.06 117.76 1.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 1.6599999999999999 109.306 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -76.62 -40.9 47.9 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 5.0 110.326 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 12.5 p90 -178.24 -170.21 0.22 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.541 1.15 . . . . 1.8300000000000001 110.959 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.467 HD22 ' CG2' ' A' ' 35' ' ' VAL . 51.8 mt -114.64 134.5 55.02 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.516 1.135 . . . . 2.2599999999999998 109.329 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 34' ' ' LYS . . . -113.92 130.0 56.55 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.478 1.111 . . . . 1.8200000000000001 109.297 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.428 HH21 ' HB3' ' A' ' 9' ' ' PRO . 3.3 ptp180 -86.49 138.69 31.54 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 5.8700000000000001 110.276 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 O-C-N 124.486 1.116 . . . . 2.7599999999999998 108.295 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.533 ' O ' ' CB ' ' A' ' 71' ' ' ALA . 1.3 tt0 . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 110.267 -0.272 . . . . 3.73 110.267 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 142.93 28.56 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.538 1.81 . . . . 0.82999999999999996 111.031 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.482 ' CB ' ' CD ' ' A' ' 9' ' ' PRO . . . -74.43 179.81 1.2 Allowed Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.482 1.114 . . . . 2.1600000000000001 109.296 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' A' ' 8' ' ' ALA . 18.4 Cg_endo -74.94 165.19 31.88 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.545 1.813 . . . . 1.1000000000000001 111.018 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.7 m -90.47 16.26 9.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.554 1.159 . . . . 3.1000000000000001 110.006 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.455 ' O ' ' N ' ' A' ' 26' ' ' GLY . 26.6 p -108.43 12.28 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.493 1.121 . . . . 0.90000000000000002 108.293 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 75.4 t -128.07 117.57 46.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 1.6699999999999999 109.288 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.42 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -81.34 145.45 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 2.27 110.386 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.489 HD12 ' CG2' ' A' ' 35' ' ' VAL . 43.9 tp -101.63 105.46 16.4 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 2.02 109.326 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.547 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -98.08 65.91 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 2.02 110.999 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.693 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 6.7 tt0 -79.5 118.27 21.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.449 1.093 . . . . 1.46 110.312 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -100.84 -157.55 0.62 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.505 1.128 . . . . 1.9299999999999999 110.007 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.574 ' CZ3' ' HB3' ' A' ' 19' ' ' ARG . 62.9 p-90 -96.06 -45.35 6.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.522 1.139 . . . . 2.3100000000000001 107.991 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 17.9 ptt180 -77.53 -37.02 51.78 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.45 1.094 . . . . 8.0099999999999998 110.31 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.634 ' CD2' ' HA2' ' A' ' 57' ' ' GLY . 0.3 OUTLIER -164.6 173.7 11.67 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 7.1900000000000004 111.01 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.51 ' O ' ' CG2' ' A' ' 55' ' ' THR . 54.4 p -116.75 158.12 24.38 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 3.3100000000000001 109.992 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.547 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 0.6 OUTLIER -142.76 134.44 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.475 1.109 . . . . 3.0499999999999998 110.315 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -98.01 128.68 44.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 1.9099999999999999 109.282 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.435 ' HA ' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -106.22 120.4 41.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.547 1.155 . . . . 2.48 109.32 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.485 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 60.6 t-20 -77.81 89.98 4.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.549 1.155 . . . . 0.56000000000000005 109.286 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -83.98 8.16 67.8 Favored Glycine 0 CA--C 1.531 1.036 0 O-C-N 124.527 1.142 . . . . 0.76000000000000001 110.989 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.65 -156.36 0.24 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.314 -0.995 . . . . 1.8 108.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.35 18.84 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.51 1.131 . . . . 1.8200000000000001 109.279 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.412 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 6.2 mt-10 -155.85 135.05 12.19 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.119 . . . . 1.99 110.241 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.5 m -41.67 124.83 2.62 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 1.5800000000000001 110.406 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.35 154.8 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 2.3599999999999999 109.292 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.493 HG23 ' SG ' ' A' ' 45' ' ' CYS . 30.7 m -108.09 146.18 33.0 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 1.77 110.378 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.519 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 2.6 m -138.16 172.01 14.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.54 1.15 . . . . 2.1099999999999999 109.278 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.4 ' HD3' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -162.01 101.11 1.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.468 1.105 . . . . 3.8599999999999999 109.279 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.517 ' CG2' HD22 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -59.98 133.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.457 1.098 . . . . 1.8500000000000001 109.344 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 68' ' ' ARG . 90.6 t -113.22 124.68 70.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 1.8999999999999999 109.296 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.638 ' CZ ' ' OD1' ' A' ' 58' ' ' ASP . 11.7 m-85 -75.83 166.35 23.65 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.446 1.092 . . . . 2.2599999999999998 111.025 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.408 ' O ' ' OE1' ' A' ' 38' ' ' GLU . 1.7 tm-20 -72.26 -8.01 52.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.143 . . . . 3.4199999999999999 110.308 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -95.69 10.13 37.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.524 1.14 . . . . 2.0299999999999998 109.251 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 80.78 8.47 1.21 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 4.9800000000000004 109.294 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.41 ' OG1' ' HB2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -79.77 166.71 21.48 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.514 1.134 . . . . 2.7799999999999998 110.429 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . 0.401 ' OE1' HG21 ' A' ' 36' ' ' VAL . 2.4 mt-10 -131.93 153.11 50.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.516 1.135 . . . . 3.25 110.308 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 35' ' ' VAL . . . -99.38 33.31 6.28 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.463 1.102 . . . . 3.3900000000000001 110.966 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 46' ' ' TYR . 0.5 OUTLIER 60.35 151.8 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.51 0.77 . . . . 3.4199999999999999 109.327 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 1.022 ' SG ' ' SG ' ' A' ' 73' ' ' CYS . 0.0 OUTLIER -85.26 141.54 30.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.521 1.138 . . . . 2.77 108.253 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.594 ' CD1' ' O ' ' A' ' 45' ' ' CYS . 27.7 m-85 -150.29 135.71 18.07 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.49 1.118 . . . . 3.1600000000000001 110.995 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.46 141.73 28.41 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 2.2400000000000002 109.277 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.485 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 44.2 t -137.15 134.06 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.134 . . . . 1.98 109.321 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.83 166.44 40.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 1.6100000000000001 109.325 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.412 ' HB3' ' N ' ' A' ' 29' ' ' GLU . 18.3 Cg_endo -75.02 113.96 3.91 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.503 1.791 . . . . 0.81000000000000005 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.72 8.57 54.25 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.512 1.133 . . . . 0.79000000000000004 111.024 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.12 161.85 17.83 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.539 0.788 . . . . 2.4700000000000002 110.324 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.531 ' CG2' ' HG2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -128.7 148.32 33.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 3.1600000000000001 109.299 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.45 ' HB ' ' CG2' ' A' ' 48' ' ' VAL . 0.4 OUTLIER -150.38 136.29 18.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 2.1299999999999999 110.399 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.51 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.4 m -74.75 138.4 42.68 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.523 1.139 . . . . 1.8600000000000001 110.43 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.5 m -110.45 -51.28 6.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.501 1.125 . . . . 2.3700000000000001 109.323 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.634 ' HA2' ' CD2' ' A' ' 20' ' ' TYR . . . 133.09 117.4 1.82 Allowed Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.513 1.133 . . . . 3.0800000000000001 110.993 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.638 ' OD1' ' CZ ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 162.6 130.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.528 0.781 . . . . 6.9400000000000004 109.276 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -144.75 116.38 0.93 Allowed Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.49 1.119 . . . . 2.4500000000000002 110.942 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.726 ' O ' ' CG ' ' A' ' 60' ' ' TYR . 0.5 OUTLIER -78.99 50.38 1.02 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.474 0.749 . . . . 2.7999999999999998 111.03 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.503 ' CG2' ' HB2' ' A' ' 18' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 3.8900000000000001 109.34 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.475 ' C ' ' CD2' ' A' ' 66' ' ' HIS . . . . . . . . 0 CA--C 1.53 0.993 0 N-CA-C 110.95 -0.86 . . . . 1.52 110.95 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.565 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -131.79 135.43 46.76 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.503 0.766 . . . . 1.4299999999999999 109.567 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.693 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -38.82 128.95 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.547 1.154 . . . . 1.47 109.277 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' A' ' 36' ' ' VAL . 2.1 ttt180 -77.34 -49.27 15.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 6.71 110.333 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -176.01 173.48 2.25 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.535 1.147 . . . . 2.46 111.031 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.517 HD22 ' CG2' ' A' ' 35' ' ' VAL . 7.7 mt -96.24 135.98 37.33 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.499 1.124 . . . . 2.0600000000000001 109.277 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.533 ' CB ' ' O ' ' A' ' 6' ' ' GLU . . . -117.18 163.37 16.39 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.461 1.101 . . . . 1.77 109.317 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HG3' ' CG ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -114.81 136.85 52.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.522 1.139 . . . . 3.9300000000000002 110.249 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 1.022 ' SG ' ' SG ' ' A' ' 45' ' ' CYS . 1.4 t . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.497 1.123 . . . . 2.23 108.263 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' CB ' ' A' ' 71' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 110.332 -0.248 . . . . 3.3399999999999999 110.332 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 139.52 24.41 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.531 1.806 . . . . 0.63 111.013 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.429 ' HA ' ' CG ' ' A' ' 72' ' ' ARG . . . -53.83 164.07 1.0 Allowed Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.12 . . . . 1.6100000000000001 109.34 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HD3' ' CD ' ' A' ' 72' ' ' ARG . 18.1 Cg_endo -75.02 172.13 16.97 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.424 1.749 . . . . 0.89000000000000001 111.009 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 95.6 p -83.33 8.49 13.42 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 3.4100000000000001 110.034 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 15.7 p -110.14 29.15 7.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.51 1.131 . . . . 1.0 108.315 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 83.1 t -145.18 114.94 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 1.71 109.326 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.6 142.62 28.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.53 1.144 . . . . 2.0800000000000001 110.362 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.467 HD12 ' CG2' ' A' ' 35' ' ' VAL . 20.1 tp -85.47 157.95 20.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.52 1.138 . . . . 2.25 109.29 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -148.97 76.06 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 2.5 111.006 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -79.93 141.5 35.99 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.475 1.11 . . . . 2.2599999999999998 110.296 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' SER . . . . . 0.473 ' O ' ' CD1' ' A' ' 60' ' ' TYR . 81.4 p -115.35 -128.24 0.29 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 2.5899999999999999 109.984 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.671 ' HA ' ' CD1' ' A' ' 60' ' ' TYR . 41.2 p-90 -94.07 -68.4 0.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.561 1.163 . . . . 6.0300000000000002 108.047 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.646 ' HB2' ' CE3' ' A' ' 18' ' ' TRP . 2.1 ttp180 -118.12 37.06 4.11 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.409 1.068 . . . . 9.9800000000000004 110.289 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -177.67 159.25 1.43 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 6.6399999999999997 110.977 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.597 ' CB ' ' HB2' ' A' ' 58' ' ' ASP . 40.4 m -131.77 166.25 21.96 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.464 1.102 . . . . 2.8199999999999998 109.995 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.457 ' N ' ' O ' ' A' ' 15' ' ' TYR . 5.1 tt0 -138.85 140.83 38.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.466 1.104 . . . . 2.5 110.311 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.07 123.26 47.5 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.534 1.147 . . . . 1.6399999999999999 109.339 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -100.17 120.28 39.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.499 1.124 . . . . 2.0800000000000001 109.303 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.479 ' CB ' ' O ' ' A' ' 49' ' ' ALA . 20.2 t-20 -78.7 101.39 7.5 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.48 1.113 . . . . 0.93000000000000005 109.361 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.24 -0.52 76.86 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.493 1.121 . . . . 0.82999999999999996 110.991 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' CYS . . . . . 0.519 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -85.32 -158.66 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.295 -1.002 . . . . 1.5900000000000001 108.295 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.47 ' HA ' ' CB ' ' A' ' 50' ' ' PRO . . . -133.4 28.47 4.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 1.8200000000000001 109.264 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.439 ' N ' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -154.04 150.35 28.14 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.424 1.077 . . . . 3.25 110.309 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.2 m -73.76 127.66 33.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.435 1.085 . . . . 2.3399999999999999 110.38 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.2 m -142.25 166.61 16.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 1.8700000000000001 109.301 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.441 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 23.3 m -116.12 138.65 51.07 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.114 . . . . 2.02 110.372 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.97 172.5 9.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.521 1.138 . . . . 2.2200000000000002 109.267 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -148.19 118.06 7.15 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.555 1.159 . . . . 3.1600000000000001 109.288 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.505 ' CG1' ' OD2' ' A' ' 58' ' ' ASP . 0.4 OUTLIER -58.77 146.9 8.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.527 1.142 . . . . 2.0499999999999998 109.308 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' VAL . . . . . 0.4 ' O ' ' N ' ' A' ' 68' ' ' ARG . 73.4 t -126.79 123.22 62.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.558 1.161 . . . . 1.79 109.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 89.5 m-85 -74.29 163.0 28.34 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.467 1.105 . . . . 2.27 111.014 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.2 OUTLIER -62.52 -12.07 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.512 1.132 . . . . 3.5699999999999998 110.343 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.62 5.5 35.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.484 1.115 . . . . 1.8700000000000001 109.31 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.9 OUTLIER 80.08 -2.91 1.99 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.453 1.096 . . . . 4.21 109.275 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' THR . . . . . 0.407 ' OG1' ' OD2' ' A' ' 39' ' ' ASP . 1.2 p -80.11 172.81 13.28 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.516 1.135 . . . . 2.0899999999999999 110.396 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -140.94 159.73 41.59 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.424 1.078 . . . . 1.8600000000000001 110.303 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.79 -99.66 1.09 Allowed Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.563 1.164 . . . . 1.9099999999999999 110.972 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.6 mt -141.24 145.1 35.15 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.513 0.772 . . . . 2.6600000000000001 109.324 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . 0.441 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.7 OUTLIER -81.05 131.54 35.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.544 1.153 . . . . 1.8 108.302 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.56 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 28.8 m-85 -138.92 145.34 39.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.102 . . . . 3.02 110.969 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.15 129.83 40.58 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.508 1.13 . . . . 1.5900000000000001 109.278 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.467 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 50.9 t -124.79 144.93 33.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.489 1.118 . . . . 1.55 109.291 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ALA . . . . . 0.479 ' O ' ' CB ' ' A' ' 25' ' ' ASN . . . -89.75 166.76 19.45 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.541 1.151 . . . . 1.77 109.315 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.47 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 18.2 Cg_endo -74.99 123.18 7.7 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.504 1.792 . . . . 1.1499999999999999 111.013 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.01 21.74 41.16 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 124.527 1.142 . . . . 1.1899999999999999 110.994 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.463 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -134.2 169.81 16.62 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.518 0.775 . . . . 2.8900000000000001 110.305 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.463 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -136.74 138.13 46.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 2.23 109.268 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.467 ' CG2' ' CG2' ' A' ' 48' ' ' VAL . 0.4 OUTLIER -138.11 140.91 40.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.478 1.111 . . . . 2.0299999999999998 110.438 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' THR . . . . . 0.479 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.5 m -84.9 127.31 34.1 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.468 1.105 . . . . 1.72 110.387 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.56 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 3.9 m -101.75 -42.89 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.477 1.11 . . . . 2.6200000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.551 ' O ' ' CB ' ' A' ' 58' ' ' ASP . . . 138.79 159.4 8.03 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.553 1.158 . . . . 2.46 110.985 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.606 ' O ' ' C ' ' A' ' 19' ' ' ARG . 2.4 m-20 152.03 -171.2 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.46 0.741 . . . . 6.4900000000000002 109.291 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.554 ' HA2' ' O ' ' A' ' 18' ' ' TRP . . . 174.73 118.46 0.52 Allowed Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.495 1.122 . . . . 3.0600000000000001 111.008 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.671 ' CD1' ' HA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -101.9 11.75 38.08 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.507 0.769 . . . . 4.9000000000000004 111.057 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ILE . . . . . 0.505 HG21 ' O ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.461 0 O-C-N 124.5 1.125 . . . . 4.3799999999999999 109.265 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' GLY . . . . . . . . 0 CA--C 1.53 0.969 0 N-CA-C 111.009 -0.836 . . . . 1.53 111.009 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.48 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.3 m170 -126.68 131.61 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 0.735 . . . . 2.4100000000000001 109.634 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . 0.427 ' HB3' ' OD2' ' A' ' 58' ' ' ASP . . . -38.47 119.78 0.85 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 1.8799999999999999 109.284 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 38' ' ' GLU . 7.6 ttp85 -78.69 -44.27 24.0 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 5.8799999999999999 110.308 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 69' ' ' TYR . 7.8 p90 -176.43 167.88 2.76 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.517 1.135 . . . . 2.0699999999999998 111.0 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.49 HD22 ' CG2' ' A' ' 35' ' ' VAL . 14.4 mt -101.2 147.29 26.44 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.533 1.146 . . . . 2.6600000000000001 109.329 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 6' ' ' GLU . . . -131.33 149.04 52.72 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.524 1.14 . . . . 2.0800000000000001 109.267 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -88.72 150.73 22.83 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 1.108 . . . . 4.8399999999999999 110.277 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.5 m . . . . . 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 2.8300000000000001 108.301 -179.989 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.427 ' O ' ' N ' ' A' ' 3' ' ' THR . 10.3 t0 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.313 -0.625 . . . . 14.210000000000001 109.313 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 5.9 m 44.22 -96.21 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 1.104 . . . . 14.99 110.393 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.427 ' N ' ' O ' ' A' ' 1' ' ' ASP . 0.9 OUTLIER -117.69 129.13 55.54 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 13.84 110.391 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -148.18 136.87 15.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 8.7100000000000009 109.327 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.53 ' O ' ' CB ' ' A' ' 6' ' ' GLU . 1.4 m -54.79 -93.21 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 3.77 109.985 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.53 ' CB ' ' O ' ' A' ' 5' ' ' SER . 4.7 tt0 88.23 142.69 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 3.7400000000000002 110.322 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.468 ' HD2' ' CG ' ' A' ' 6' ' ' GLU . 18.3 Cg_endo -74.99 144.8 30.71 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.507 1.793 . . . . 0.95999999999999996 111.008 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.18 173.21 0.75 Allowed Pre-proline 0 C--N 1.326 -0.428 0 O-C-N 124.509 1.131 . . . . 1.6399999999999999 109.325 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.403 ' HB2' ' SG ' ' A' ' 11' ' ' CYS . 18.2 Cg_endo -74.99 172.13 16.96 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.526 1.803 . . . . 1.1299999999999999 111.004 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.51 11.16 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 2.79 110.037 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 26' ' ' GLY . 7.9 p -108.29 20.75 18.25 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.533 1.146 . . . . 0.97999999999999998 108.261 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.442 ' CG1' ' O ' ' A' ' 24' ' ' ASP . 43.9 t -138.28 131.46 40.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.565 1.166 . . . . 2.1600000000000001 109.27 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' LEU . 1.1 m -97.92 167.02 11.17 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.498 1.124 . . . . 3.4300000000000002 110.389 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.495 ' CD1' HD22 ' A' ' 70' ' ' LEU . 14.7 tp -123.76 130.91 53.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 1.8600000000000001 109.267 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -115.67 70.14 0.74 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 1.125 . . . . 1.8100000000000001 110.985 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.643 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.9 tt0 -91.92 102.19 14.76 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.493 1.121 . . . . 1.5700000000000001 110.284 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' CA ' ' A' ' 59' ' ' GLY . 10.5 p -106.68 -152.92 0.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 2.3799999999999999 110.007 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.515 ' O ' ' CD1' ' A' ' 61' ' ' ILE . 55.7 p-90 -93.35 -27.54 16.71 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.496 1.122 . . . . 3.04 107.981 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -77.2 -61.64 1.92 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 7.2000000000000002 110.337 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 2.6 p90 -159.25 177.09 11.4 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.125 . . . . 8.7799999999999994 110.998 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.77 132.97 52.13 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.544 1.153 . . . . 2.98 110.036 179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.564 HE21 ' N ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -120.65 142.9 49.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 3.5899999999999999 110.286 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.564 ' N ' HE21 ' A' ' 22' ' ' GLN . . . -112.7 123.75 51.0 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.509 1.131 . . . . 2.1099999999999999 109.259 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.442 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 39.6 t0 -107.47 126.15 52.15 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.469 1.106 . . . . 2.3100000000000001 109.332 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.474 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 56.5 t-20 -94.04 89.67 6.12 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.543 1.152 . . . . 0.75 109.309 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -81.27 8.34 58.35 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.525 1.14 . . . . 1.02 110.981 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -179.99 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.301 -1.0 . . . . 1.8 108.301 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.444 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -115.49 21.25 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 2.1000000000000001 109.294 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.424 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 6.5 mt-10 -154.02 137.99 16.34 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.464 1.102 . . . . 2.1299999999999999 110.301 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.8 m -51.72 130.3 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.533 1.146 . . . . 1.7 110.455 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 20.9 m -140.29 153.65 22.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 2.3199999999999998 109.287 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.435 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 54.8 m -113.15 133.13 55.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.56 1.163 . . . . 2.21 110.397 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.4 m -135.24 179.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 2.0699999999999998 109.275 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.432 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 13.6 pttm -159.7 108.88 1.81 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.544 1.152 . . . . 3.4100000000000001 109.253 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.543 ' CG2' ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.59 114.59 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 1.47 109.311 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.49 ' O ' ' N ' ' A' ' 68' ' ' ARG . 19.4 t -97.33 121.18 47.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 1.8700000000000001 109.289 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.415 ' HA ' ' HA ' ' A' ' 67' ' ' ALA . 70.4 m-85 -78.89 178.62 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.489 1.118 . . . . 1.9099999999999999 111.021 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.48 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 0.4 OUTLIER -84.61 -9.77 57.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.487 1.117 . . . . 3.2000000000000002 110.273 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.488 ' HB2' ' CG2' ' A' ' 41' ' ' THR . 0.0 OUTLIER -81.59 0.93 36.12 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.546 1.154 . . . . 2.0800000000000001 109.299 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.488 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 81.52 31.0 0.13 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.15 . . . . 3.6800000000000002 109.317 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.488 ' CG2' ' HB2' ' A' ' 39' ' ' ASP . 0.2 OUTLIER -124.44 174.28 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 3.25 110.392 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 36' ' ' VAL . 1.7 mp0 -135.84 151.24 49.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.511 1.132 . . . . 2.6800000000000002 110.3 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.601 ' O ' ' CE2' ' A' ' 46' ' ' TYR . . . -87.78 46.51 3.45 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 124.55 1.156 . . . . 3.2400000000000002 111.019 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.98 154.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 0.754 . . . . 3.2999999999999998 109.301 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.435 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.8 OUTLIER -91.1 123.07 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 2.04 108.298 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CE2' ' O ' ' A' ' 43' ' ' GLY . 25.8 m-85 -124.93 137.59 54.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.48 1.112 . . . . 2.8799999999999999 110.971 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.85 130.21 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.117 . . . . 1.78 109.277 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.474 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 40.6 t -126.81 138.02 56.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 2.1000000000000001 109.285 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.417 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -81.07 172.9 8.65 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 2.3999999999999999 109.291 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.444 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.3 Cg_endo -75.08 99.32 1.24 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.522 1.801 . . . . 0.87 110.979 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.3 30.13 3.22 Favored Glycine 0 CA--C 1.53 1.001 0 O-C-N 124.496 1.122 . . . . 1.1499999999999999 110.982 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.453 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 34.4 tt0 -125.49 153.29 43.78 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.465 0.744 . . . . 3.4199999999999999 110.327 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.453 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -139.33 120.77 15.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.51 1.131 . . . . 2.2200000000000002 109.333 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.545 ' N ' HE22 ' A' ' 22' ' ' GLN . 0.7 OUTLIER -143.04 154.66 44.2 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.094 . . . . 2.54 110.415 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.563 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -61.88 146.68 49.05 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.526 1.142 . . . . 1.8200000000000001 110.398 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.502 ' CG1' ' CB ' ' A' ' 23' ' ' ALA . 29.2 m -139.33 11.12 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.52 1.137 . . . . 2.5699999999999998 109.293 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 170.38 -169.58 42.39 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.457 1.098 . . . . 2.3799999999999999 110.947 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.437 ' C ' ' HA ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -104.42 -170.73 1.81 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.471 0.748 . . . . 5.8499999999999996 109.299 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.427 ' CA ' ' O ' ' A' ' 17' ' ' SER . . . -88.27 175.05 44.2 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.507 1.129 . . . . 2.2400000000000002 110.969 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' ND1' ' A' ' 66' ' ' HIS . 0.6 OUTLIER -94.2 36.04 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.474 0.75 . . . . 3.3100000000000001 111.022 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.515 ' CD1' ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.18 -8.42 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 3.7000000000000002 109.283 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.42 4.72 17.48 Favored Glycine 0 CA--C 1.529 0.959 0 O-C-N 124.53 1.144 . . . . 3.4300000000000002 111.02 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.3 m -59.3 -98.57 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.483 0.755 . . . . 4.4900000000000002 109.987 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.415 ' O ' ' OD1' ' A' ' 39' ' ' ASP . 0.4 OUTLIER -91.59 33.11 1.03 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.466 1.104 . . . . 2.6600000000000001 109.63 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.97 -147.35 21.78 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.518 1.137 . . . . 1.3700000000000001 111.017 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.427 ' ND1' ' HB2' ' A' ' 60' ' ' TYR . 5.3 m-70 -125.15 116.28 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 0.765 . . . . 1.47 109.598 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.643 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -40.6 118.63 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.528 1.142 . . . . 1.8200000000000001 109.312 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -78.01 -45.39 23.85 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 7.0 110.269 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 68' ' ' ARG . 5.2 p90 177.21 166.94 0.58 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 2.52 111.002 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.543 ' CD2' ' CG2' ' A' ' 35' ' ' VAL . 10.9 mt -85.06 136.46 33.56 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.548 1.155 . . . . 2.4300000000000002 109.319 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.405 ' HA ' ' O ' ' A' ' 6' ' ' GLU . . . -116.6 138.05 51.72 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.542 1.151 . . . . 1.5800000000000001 109.309 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -81.29 147.19 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.474 1.109 . . . . 4.5099999999999998 110.306 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -4.33 49.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.484 1.115 . . . . 2.5099999999999998 108.292 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 14.3 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.997 -1.477 . . . . 5.9800000000000004 109.276 -179.977 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.429 ' O ' ' CB ' ' A' ' 2' ' ' THR . 9.9 p-10 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.312 -0.625 . . . . 14.06 109.312 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 1' ' ' ASP . 0.9 OUTLIER 171.51 -34.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.51 1.131 . . . . 10.550000000000001 110.378 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.5 p -42.39 121.32 1.9 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.551 1.157 . . . . 7.5199999999999996 110.401 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 m 40.06 40.71 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.46 1.1 . . . . 9.0800000000000001 109.28 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -177.2 -156.33 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.428 1.08 . . . . 4.5300000000000002 110.024 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -170.5 141.97 1.66 Allowed Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.121 . . . . 3.2599999999999998 110.299 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.99 149.41 36.71 Favored 'Trans proline' 0 C--N 1.36 1.136 0 O-C-N 124.49 1.784 . . . . 1.3100000000000001 110.954 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.401 ' HB1' ' C ' ' A' ' 70' ' ' LEU . . . -84.77 166.56 31.42 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.133 . . . . 1.9199999999999999 109.316 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HD3' ' CD ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 173.01 15.26 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.473 1.775 . . . . 1.0900000000000001 110.977 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.1 9.74 29.7 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.539 1.149 . . . . 4.1900000000000004 110.0 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 9' ' ' PRO . 11.8 p -91.05 -36.8 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 2.0899999999999999 108.312 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 84.5 t -79.08 115.51 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 1.8600000000000001 109.29 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.414 ' OG1' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -83.59 158.12 22.04 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.499 1.124 . . . . 2.3399999999999999 110.404 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.482 HD12 ' CG2' ' A' ' 35' ' ' VAL . 11.4 tp -113.13 112.22 23.44 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.48 1.113 . . . . 2.02 109.292 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.484 ' HB3' ' CB ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -96.19 59.22 1.9 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.518 1.136 . . . . 2.9900000000000002 110.963 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.436 ' NE2' ' HB3' ' A' ' 60' ' ' TYR . 6.1 tt0 -78.23 117.83 19.87 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.467 1.104 . . . . 2.0499999999999998 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.55 ' OG ' ' O ' ' A' ' 20' ' ' TYR . 6.4 p -107.88 -149.36 0.43 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.557 1.16 . . . . 1.6899999999999999 110.001 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.653 ' CE3' ' N ' ' A' ' 19' ' ' ARG . 24.3 p-90 -106.68 -42.81 4.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.499 1.124 . . . . 2.6200000000000001 108.03 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.653 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -78.31 -33.25 49.42 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 9.2300000000000004 110.339 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.65 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER -167.4 160.08 13.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.136 . . . . 8.9600000000000009 110.979 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.503 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 5.6 m -112.22 144.22 41.99 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.511 1.132 . . . . 3.4399999999999999 110.003 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.536 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 1.7 tt0 -126.77 172.75 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.12 . . . . 2.3100000000000001 110.307 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.41 125.15 22.4 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.56 1.163 . . . . 1.96 109.273 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.414 ' OD1' ' OG1' ' A' ' 13' ' ' THR . 0.0 OUTLIER -97.89 137.34 36.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 2.5 109.264 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.48 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 34.9 t-20 -95.69 81.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.78000000000000003 109.252 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.84 20.52 27.93 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.502 1.126 . . . . 1.1599999999999999 110.989 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' O ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -94.05 10.11 34.95 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.28 -1.007 . . . . 3.0099999999999998 108.28 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.466 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.88 32.68 0.11 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.448 1.092 . . . . 3.2599999999999998 109.327 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.4 OUTLIER -163.03 138.68 6.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.52 1.138 . . . . 2.54 110.299 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -54.62 118.95 4.61 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 1.99 110.423 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -143.88 173.4 5.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.485 1.116 . . . . 1.72 109.281 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 60.0 m -124.56 141.97 51.69 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 1.49 110.424 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.6 m -141.91 175.34 5.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.092 . . . . 1.98 109.275 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.495 ' HG2' ' CB ' ' A' ' 71' ' ' ALA . 16.0 ptmt -156.6 112.01 2.9 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 4.0300000000000002 109.309 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.482 ' CG2' HD12 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -56.48 132.4 20.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 1.6399999999999999 109.26 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.537 HG13 ' CZ ' ' A' ' 69' ' ' TYR . 78.6 t -116.96 118.64 59.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 2.21 109.328 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.607 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 74.1 m-85 -76.44 166.33 23.57 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.505 1.128 . . . . 1.9399999999999999 111.018 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.485 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.91 -9.77 32.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.53 1.144 . . . . 3.0899999999999999 110.312 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -90.47 19.09 5.51 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.142 . . . . 2.6600000000000001 109.344 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.72 13.72 5.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.471 1.107 . . . . 4.2300000000000004 109.291 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -93.31 161.94 14.2 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.139 . . . . 2.04 110.401 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -135.52 146.08 47.71 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 2.8100000000000001 110.334 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.487 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -73.14 -92.63 0.11 Allowed Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.475 1.109 . . . . 1.8400000000000001 110.967 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.487 ' CD2' ' O ' ' A' ' 43' ' ' GLY . 42.4 mt -153.31 144.45 23.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.446 0.733 . . . . 2.4100000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.9 m -75.75 105.5 6.82 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.566 1.166 . . . . 2.2799999999999998 108.327 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 8.1 m-30 -112.97 142.12 46.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.518 1.136 . . . . 3.0499999999999998 110.979 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.22 122.8 40.65 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.471 1.107 . . . . 1.74 109.31 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.48 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 74.8 t -113.71 140.68 32.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.513 1.133 . . . . 1.5900000000000001 109.281 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.471 ' O ' ' ND2' ' A' ' 25' ' ' ASN . . . -80.8 177.54 2.93 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 1.49 109.314 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.466 ' HB3' ' C ' ' A' ' 28' ' ' ALA . 18.4 Cg_endo -74.99 108.49 2.73 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.486 1.782 . . . . 1.1699999999999999 111.002 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.66 6.41 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.441 1.088 . . . . 0.73999999999999999 111.027 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.466 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 12.1 tt0 -134.98 157.84 45.88 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.462 0.742 . . . . 2.4500000000000002 110.34 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.466 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -130.22 137.22 56.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.523 1.139 . . . . 2.1400000000000001 109.286 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.42 ' C ' ' HG2' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -143.68 143.64 31.52 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 1.6100000000000001 110.445 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.536 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.2 OUTLIER -69.2 131.96 45.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.489 1.118 . . . . 1.9199999999999999 110.422 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.475 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 12.2 m -119.09 -10.13 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.476 1.11 . . . . 2.0499999999999998 109.253 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -171.41 -172.88 37.94 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.501 1.125 . . . . 2.4199999999999999 111.026 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.503 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.5 m-20 -90.11 -166.32 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.504 0.767 . . . . 6.2699999999999996 109.279 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -86.56 170.47 42.38 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.5 1.125 . . . . 2.52 111.021 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.566 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -92.6 40.99 1.06 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.517 0.775 . . . . 3.5899999999999999 111.012 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.53 ' CD1' ' O ' ' A' ' 18' ' ' TRP . 0.1 OUTLIER -78.2 -4.5 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.461 1.101 . . . . 3.77 109.324 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 113.13 5.06 23.63 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.521 1.138 . . . . 3.6299999999999999 111.029 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 64' ' ' HIS . 94.2 p -59.18 -97.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.465 0.744 . . . . 5.04 110.023 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.607 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -90.58 25.59 2.26 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.53 1.144 . . . . 2.9399999999999999 109.637 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 92.27 -156.23 23.33 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.532 1.145 . . . . 1.3400000000000001 110.998 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.516 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.0 OUTLIER -124.52 119.16 28.32 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.541 0.789 . . . . 1.52 109.56 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -45.2 108.79 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.491 1.119 . . . . 1.8999999999999999 109.316 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -77.51 -31.2 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.489 1.118 . . . . 5.25 110.314 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CZ ' HG13 ' A' ' 36' ' ' VAL . 15.7 p90 -173.93 175.69 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.503 1.127 . . . . 2.0299999999999998 110.973 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.465 ' CD2' ' HA ' ' A' ' 35' ' ' VAL . 51.7 mt -106.41 140.2 39.7 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.466 1.104 . . . . 2.3999999999999999 109.294 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.495 ' CB ' ' HG2' ' A' ' 34' ' ' LYS . . . -107.78 142.79 37.27 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.538 1.149 . . . . 1.77 109.342 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -87.63 139.92 30.05 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 4.9400000000000004 110.279 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.85 123.71 35.77 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 2.75 108.3 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.001 -1.476 . . . . 5.9900000000000002 109.285 -179.991 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 2' ' ' THR . 9.2 t0 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.32 -0.622 . . . . 13.56 109.32 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.542 ' OG1' ' N ' ' A' ' 3' ' ' THR . 0.0 OUTLIER 29.96 -96.8 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.44 1.088 . . . . 10.18 110.443 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.542 ' N ' ' OG1' ' A' ' 2' ' ' THR . 9.4 t -160.48 156.47 26.01 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.535 1.147 . . . . 8.9100000000000001 110.401 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 25.5 t 68.07 83.44 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.492 1.12 . . . . 9.0700000000000003 109.336 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -77.65 0.17 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 3.8300000000000001 110.015 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.18 95.59 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 3.9900000000000002 110.29 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 142.65 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.517 1.798 . . . . 0.62 111.03 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.32 158.48 56.69 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.499 1.125 . . . . 1.8799999999999999 109.3 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 171.36 18.47 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.472 1.775 . . . . 0.89000000000000001 110.969 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -85.41 9.13 16.49 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.491 1.12 . . . . 2.5299999999999998 109.982 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.8 p -104.74 23.19 13.81 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.509 1.131 . . . . 1.01 108.298 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 84.7 t -146.03 116.02 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.461 1.1 . . . . 1.8 109.303 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.435 ' N ' ' O ' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -81.24 161.81 23.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 2.02 110.44 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.471 ' CD1' HG22 ' A' ' 35' ' ' VAL . 16.1 tp -118.63 106.08 12.25 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.481 1.113 . . . . 1.79 109.292 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.465 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -87.24 61.72 6.85 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.475 1.109 . . . . 2.52 110.98 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.552 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 35.4 tt0 -78.24 96.84 5.34 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.572 1.17 . . . . 1.6899999999999999 110.327 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.34 -163.0 0.93 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 3.6000000000000001 109.996 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.577 ' CZ3' ' HB3' ' A' ' 19' ' ' ARG . 66.1 p-90 -99.14 -49.79 4.37 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.479 1.112 . . . . 3.2400000000000002 108.045 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.577 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.03 -21.11 59.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 7.9500000000000002 110.284 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' CB ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -166.87 175.51 7.68 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.577 1.173 . . . . 5.9699999999999998 110.976 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 58' ' ' ASP . 6.0 m -141.58 138.5 32.69 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 3.7000000000000002 109.968 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -137.66 -179.97 6.07 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.57 1.169 . . . . 2.98 110.284 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.425 ' CB ' HD12 ' A' ' 70' ' ' LEU . . . -134.03 129.95 36.83 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 1.8200000000000001 109.33 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.475 ' N ' ' OD1' ' A' ' 24' ' ' ASP . 0.1 OUTLIER -95.12 136.25 35.67 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.555 1.16 . . . . 4.6299999999999999 109.301 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.447 ' HB3' ' O ' ' A' ' 49' ' ' ALA . 60.0 t-20 -96.49 87.22 4.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.093 . . . . 0.54000000000000004 109.301 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.44 13.04 53.58 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.526 1.141 . . . . 0.56999999999999995 110.985 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.2 -155.64 0.33 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.328 -0.99 . . . . 1.6000000000000001 108.328 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.59 20.98 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.117 . . . . 1.9299999999999999 109.313 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.408 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -155.95 152.26 27.99 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 3.1099999999999999 110.29 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.1 m -65.8 125.64 25.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 1.98 110.353 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.24 159.52 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.424 1.077 . . . . 1.6299999999999999 109.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.466 HG23 ' CB ' ' A' ' 73' ' ' CYS . 67.1 m -114.58 143.71 44.56 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 1.6200000000000001 110.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 3.4 m -141.09 177.84 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 1.97 109.285 -179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.96 105.53 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 2.79 109.291 179.976 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.488 ' O ' ' CG1' ' A' ' 35' ' ' VAL . 0.4 OUTLIER -53.7 116.01 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 1.6200000000000001 109.3 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.425 ' O ' ' N ' ' A' ' 68' ' ' ARG . 23.2 t -99.39 120.36 48.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.461 1.101 . . . . 1.9199999999999999 109.292 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CG ' ' O ' ' A' ' 64' ' ' HIS . 96.4 m-85 -83.94 167.92 16.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 1.7 110.939 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.501 ' CG ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -58.47 -21.5 51.76 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.472 1.108 . . . . 3.98 110.286 179.986 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -79.82 3.56 19.24 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.533 1.146 . . . . 2.29 109.313 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 75.22 3.06 4.02 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.485 1.116 . . . . 4.2199999999999998 109.281 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.406 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.4 p -78.73 144.94 34.78 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.492 1.12 . . . . 2.1699999999999999 110.404 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.416 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 0.4 OUTLIER -121.36 142.38 50.04 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.497 1.123 . . . . 2.48 110.299 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.494 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -60.88 -106.65 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.484 1.115 . . . . 1.8300000000000001 110.961 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.494 ' CD2' ' O ' ' A' ' 43' ' ' GLY . 47.2 mt -153.02 140.15 19.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 0.773 . . . . 2.1899999999999999 109.304 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.8 m -42.8 101.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 1.106 . . . . 2.0800000000000001 108.298 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 2.6 m-85 -108.98 111.91 23.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.46 1.1 . . . . 3.2999999999999998 111.031 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.83 128.84 35.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.52 1.138 . . . . 1.9199999999999999 109.332 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 69.6 t -128.79 140.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.465 1.103 . . . . 1.54 109.356 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -80.51 171.77 11.5 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.515 1.134 . . . . 1.8600000000000001 109.292 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.408 ' HB3' ' N ' ' A' ' 29' ' ' GLU . 18.5 Cg_endo -74.97 102.52 1.6 Allowed 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.475 1.776 . . . . 0.73999999999999999 111.044 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 105.13 36.55 2.89 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.507 1.129 . . . . 0.66000000000000003 110.989 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -144.94 158.27 43.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.545 0.791 . . . . 2.2400000000000002 110.291 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.407 HG21 ' O ' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -126.68 141.75 45.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.444 1.09 . . . . 2.21 109.326 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.444 ' C ' ' HB3' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -146.45 141.31 27.0 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.476 1.11 . . . . 1.3200000000000001 110.376 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.2 OUTLIER -59.58 141.5 54.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 1.9199999999999999 110.408 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 15.3 m -129.59 1.21 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 2.3700000000000001 109.311 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 21' ' ' SER . . . 164.37 -173.48 40.34 Favored Glycine 0 CA--C 1.529 0.962 0 O-C-N 124.55 1.156 . . . . 2.2999999999999998 111.048 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.441 ' O ' ' OG ' ' A' ' 21' ' ' SER . 7.9 m-20 -92.61 -173.58 3.4 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 0.777 . . . . 5.8700000000000001 109.305 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.513 ' O ' ' HB2' ' A' ' 63' ' ' SER . . . -83.68 -176.78 51.44 Favored Glycine 0 CA--C 1.53 0.98 0 O-C-N 124.551 1.157 . . . . 2.2000000000000002 111.03 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.566 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 3.9 p90 -101.13 27.95 5.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.501 0.765 . . . . 3.6200000000000001 111.016 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.541 HG12 ' O ' ' A' ' 18' ' ' TRP . 1.3 pp -93.36 51.48 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.512 1.132 . . . . 3.9100000000000001 109.317 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 63' ' ' SER . . . 88.74 -1.3 83.49 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.508 1.13 . . . . 3.3100000000000001 111.027 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.513 ' HB2' ' O ' ' A' ' 59' ' ' GLY . 1.1 m -60.4 -138.32 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.499 0.764 . . . . 5.4900000000000002 109.987 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.586 ' O ' ' CG ' ' A' ' 37' ' ' TYR . 1.0 OUTLIER -79.44 37.48 0.34 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.544 1.152 . . . . 3.23 109.615 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 63' ' ' SER . . . 91.87 -161.69 27.11 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.49 1.119 . . . . 1.5 111.004 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.566 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 10.6 m170 -107.93 107.0 17.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 0.764 . . . . 3.5 109.589 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.552 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -39.66 113.18 0.31 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.493 1.12 . . . . 1.48 109.28 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -78.14 -38.34 43.95 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.119 . . . . 6.9100000000000001 110.317 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.502 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 18.1 p90 179.53 -166.12 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.492 1.12 . . . . 1.8799999999999999 111.02 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.483 HD22 ' CG2' ' A' ' 35' ' ' VAL . 70.9 mt -115.24 138.24 51.16 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.527 1.142 . . . . 2.3399999999999999 109.32 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -116.42 139.4 50.48 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.499 1.124 . . . . 1.73 109.291 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.8 147.3 51.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.536 1.147 . . . . 4.1100000000000003 110.344 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.466 ' CB ' HG23 ' A' ' 32' ' ' THR . 40.7 t -79.57 -102.06 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.461 1.101 . . . . 2.6600000000000001 108.307 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-O 116.974 -1.488 . . . . 8.1600000000000001 109.261 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.309 -0.626 . . . . 15.09 109.309 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.3 p 40.48 75.17 0.09 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.512 1.133 . . . . 12.35 110.44 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 13.5 t -115.11 49.0 1.09 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.446 1.091 . . . . 9.6300000000000008 110.361 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.9 m -123.72 108.32 20.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.143 . . . . 8.3599999999999994 109.278 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.01 -149.59 0.43 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.506 1.129 . . . . 4.9699999999999998 109.97 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.419 ' CG ' ' HB2' ' A' ' 72' ' ' ARG . 43.1 tp10 -153.63 102.11 2.54 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 3.48 110.282 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 139.6 24.46 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.524 1.802 . . . . 0.75 110.998 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.41 ' HA ' ' CG ' ' A' ' 72' ' ' ARG . . . -57.29 168.45 0.95 Allowed Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 1.6299999999999999 109.313 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.0 170.0 21.39 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.518 1.799 . . . . 0.96999999999999997 111.004 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.54 13.31 12.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 2.9500000000000002 110.024 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.2 p -112.65 21.46 15.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.492 1.12 . . . . 0.95999999999999996 108.294 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 3.1 t -139.5 123.04 18.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 2.0 109.28 -179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.4 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -91.49 154.31 19.21 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.436 1.085 . . . . 2.04 110.409 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.493 HD12 ' CG2' ' A' ' 35' ' ' VAL . 6.1 tp -108.07 111.96 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 1.8100000000000001 109.319 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -93.23 58.06 2.8 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 2.3599999999999999 110.97 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.643 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.1 tt0 -74.48 98.43 3.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.52 1.138 . . . . 1.8200000000000001 110.311 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.448 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 0.9 OUTLIER -92.6 -160.84 0.78 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.483 1.115 . . . . 1.8999999999999999 109.998 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.642 ' O ' ' CD1' ' A' ' 61' ' ' ILE . 29.8 p-90 -99.5 -46.48 5.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 3.3199999999999998 107.97 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -71.67 -34.24 69.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 6.4800000000000004 110.307 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.589 ' CD2' HG23 ' A' ' 55' ' ' THR . 0.1 OUTLIER -167.45 157.29 10.62 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.138 . . . . 6.6100000000000003 111.005 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 2.8 t -105.94 134.96 48.23 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 2.8399999999999999 110.01 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.584 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 9.5 mt-30 -125.74 172.15 10.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 2.0800000000000001 110.259 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.476 ' HB3' ' CG1' ' A' ' 56' ' ' VAL . . . -134.76 129.23 34.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.523 1.14 . . . . 1.6299999999999999 109.301 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 25' ' ' ASN . 2.8 t0 -102.65 133.46 47.62 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 2.2000000000000002 109.288 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.463 ' HB3' ' O ' ' A' ' 49' ' ' ALA . 60.8 t-20 -93.67 93.77 8.21 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.489 1.118 . . . . 0.53000000000000003 109.262 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.51 9.6 70.23 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.519 1.137 . . . . 0.60999999999999999 110.993 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.55 -167.71 1.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 1.6399999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.422 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -125.2 25.44 7.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.576 1.173 . . . . 2.3999999999999999 109.3 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.411 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 10.3 mt-10 -158.09 144.82 17.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.502 1.126 . . . . 2.2999999999999998 110.28 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.0 m -61.78 128.89 38.41 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.454 1.096 . . . . 1.6699999999999999 110.359 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.21 162.25 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.497 1.123 . . . . 1.49 109.282 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.446 ' CG2' ' HB2' ' A' ' 73' ' ' CYS . 49.0 m -111.94 143.61 42.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.469 1.106 . . . . 1.52 110.405 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -140.71 177.94 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.453 1.096 . . . . 1.9099999999999999 109.318 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -160.67 110.48 1.73 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.55 1.156 . . . . 3.3199999999999998 109.329 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.504 ' O ' ' CG1' ' A' ' 35' ' ' VAL . 0.4 OUTLIER -61.88 114.35 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.46 1.1 . . . . 1.49 109.273 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.551 ' O ' ' N ' ' A' ' 68' ' ' ARG . 84.7 t -96.05 117.62 40.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.502 1.126 . . . . 1.6000000000000001 109.286 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 25.2 m-85 -75.45 173.47 10.92 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 3.1800000000000002 111.048 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.431 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 1.8 mm-40 -81.16 -12.06 59.3 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.462 1.102 . . . . 3.6400000000000001 110.255 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.457 ' CG ' ' OG1' ' A' ' 41' ' ' THR . 5.2 p-10 -93.73 34.0 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.102 . . . . 2.6499999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 46.96 67.38 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.133 . . . . 4.2599999999999998 109.306 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.457 ' OG1' ' CG ' ' A' ' 39' ' ' ASP . 1.0 OUTLIER -152.29 152.16 31.81 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.463 1.102 . . . . 1.9199999999999999 110.357 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.477 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 7.9 mt-10 -130.9 139.58 50.11 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 2.0499999999999998 110.313 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.488 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -58.95 -103.94 0.01 OUTLIER Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.537 1.148 . . . . 1.72 110.996 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.601 ' O ' ' CD2' ' A' ' 46' ' ' TYR . 45.1 mt -153.6 139.66 18.3 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 2.4700000000000002 109.319 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.7 m -51.53 103.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.496 1.123 . . . . 1.8200000000000001 108.328 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 33.2 m-85 -112.05 122.87 48.96 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 2.7599999999999998 111.017 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.67 123.77 38.3 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.493 1.121 . . . . 1.5700000000000001 109.301 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.449 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 68.2 t -122.36 138.34 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.499 1.124 . . . . 1.6000000000000001 109.318 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -80.93 173.51 7.61 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.52 1.137 . . . . 1.4399999999999999 109.35 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.422 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.2 Cg_endo -74.99 97.74 1.1 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.487 1.783 . . . . 0.73999999999999999 111.0 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 109.9 35.27 2.22 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.507 1.13 . . . . 0.80000000000000004 110.967 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -140.05 159.48 42.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.511 0.771 . . . . 3.54 110.289 -179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -128.82 140.27 49.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 O-C-N 124.496 1.122 . . . . 2.04 109.284 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.444 ' C ' ' HG2' ' A' ' 22' ' ' GLN . 0.6 OUTLIER -148.05 147.76 29.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.556 1.16 . . . . 1.4399999999999999 110.418 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.589 HG23 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -60.94 146.15 47.83 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.508 1.13 . . . . 1.6799999999999999 110.427 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.479 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 29.5 m -132.64 -0.54 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.479 1.112 . . . . 2.6600000000000001 109.332 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 162.52 -169.46 37.8 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.519 1.137 . . . . 2.25 111.014 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.51 ' O ' ' CB ' ' A' ' 21' ' ' SER . 4.4 m-20 -89.67 -164.63 1.18 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.513 0.773 . . . . 5.6699999999999999 109.309 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -86.53 -169.06 45.54 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.514 1.134 . . . . 2.0 111.007 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.684 ' CD2' HG21 ' A' ' 61' ' ' ILE . 18.5 p90 -90.86 -7.09 53.23 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.537 0.786 . . . . 2.5600000000000001 110.975 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.684 HG21 ' CD2' ' A' ' 60' ' ' TYR . 0.3 OUTLIER -101.82 9.35 8.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.552 1.158 . . . . 4.0800000000000001 109.32 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.28 -163.64 31.16 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 124.493 1.121 . . . . 4.4400000000000004 111.017 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.2 -15.14 27.96 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.54 0.788 . . . . 5.1799999999999997 109.996 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.602 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -86.29 8.76 20.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.489 1.118 . . . . 3.73 109.574 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.0 -136.72 21.03 Favored Glycine 0 CA--C 1.53 1.016 0 O-C-N 124.534 1.146 . . . . 1.0 111.011 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.583 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -118.82 131.29 56.09 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.535 0.785 . . . . 1.47 109.644 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.643 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -46.33 122.59 4.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 1.47 109.309 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -77.9 -47.38 18.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.575 1.172 . . . . 6.4500000000000002 110.287 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CE2' ' HD2' ' A' ' 68' ' ' ARG . 6.2 p90 -174.85 -177.5 1.13 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.496 1.123 . . . . 2.0499999999999998 110.988 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.487 HD22 ' CD1' ' A' ' 14' ' ' LEU . 7.9 mt -105.69 135.05 47.8 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.551 1.157 . . . . 2.6099999999999999 109.28 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -123.19 148.52 45.71 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.507 1.129 . . . . 1.76 109.295 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.419 ' HB2' ' CG ' ' A' ' 6' ' ' GLU . 3.6 mtt180 -81.3 154.49 26.51 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.511 1.132 . . . . 5.2699999999999996 110.301 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.446 ' HB2' ' CG2' ' A' ' 32' ' ' THR . 38.1 t -78.76 -117.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.124 . . . . 2.6299999999999999 108.324 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.1 0 CA-C-O 117.076 -1.44 . . . . 7.6100000000000003 109.314 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.309 -0.626 . . . . 19.77 109.309 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 m -151.13 63.1 0.9 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.117 . . . . 18.079999999999998 110.401 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 p -94.27 53.37 1.71 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.122 . . . . 12.630000000000001 110.397 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -148.68 156.45 8.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 11.460000000000001 109.299 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.41 ' O ' ' O ' ' A' ' 72' ' ' ARG . 28.6 t -156.95 -97.03 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.476 1.11 . . . . 4.6299999999999999 110.032 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.403 ' CB ' ' O ' ' A' ' 5' ' ' SER . 0.6 OUTLIER 79.13 138.99 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 3.0699999999999998 110.311 179.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 148.88 35.75 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.552 1.817 . . . . 0.84999999999999998 110.978 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -76.07 150.35 83.21 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.109 . . . . 1.97 109.325 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.425 ' HD3' ' NE ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 -176.1 2.71 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.435 1.755 . . . . 1.95 110.985 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.52 6.34 20.81 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.456 1.098 . . . . 2.6099999999999999 109.988 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 26' ' ' GLY . 2.0 p -96.42 20.09 11.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.533 1.146 . . . . 1.1399999999999999 108.327 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 70.0 t -149.47 121.83 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.517 1.135 . . . . 1.97 109.257 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.409 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -96.47 136.75 36.54 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.531 1.145 . . . . 2.1000000000000001 110.385 -179.972 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.466 HD12 ' CG2' ' A' ' 35' ' ' VAL . 32.5 tp -89.98 105.53 17.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.545 1.153 . . . . 1.8400000000000001 109.311 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.545 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -96.44 65.44 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.446 1.091 . . . . 2.02 110.958 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.446 ' OE1' ' CB ' ' A' ' 67' ' ' ALA . 17.4 tt0 -77.2 120.63 22.53 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 1.99 110.278 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.592 ' O ' ' CD2' ' A' ' 60' ' ' TYR . 6.4 p -87.77 -144.22 0.13 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.476 1.11 . . . . 1.95 109.976 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.638 ' CE3' ' HB3' ' A' ' 19' ' ' ARG . 32.4 p-90 -101.74 -54.76 2.66 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.497 1.123 . . . . 2.6099999999999999 108.012 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.638 ' HB3' ' CE3' ' A' ' 18' ' ' TRP . 2.8 ptt180 -107.67 14.75 25.32 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.489 1.118 . . . . 6.2300000000000004 110.299 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.616 ' CD1' ' HA2' ' A' ' 57' ' ' GLY . 0.2 OUTLIER -168.24 176.26 6.05 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.502 1.126 . . . . 5.8899999999999997 110.99 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.488 ' OG ' ' N ' ' A' ' 58' ' ' ASP . 5.1 p -143.61 159.73 41.93 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.496 1.122 . . . . 3.04 110.022 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.545 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 3.2 mt-30 -141.26 135.92 31.12 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.49 1.118 . . . . 2.21 110.333 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.457 ' CB ' HG23 ' A' ' 33' ' ' VAL . . . -100.51 117.87 35.55 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.47 1.106 . . . . 1.9099999999999999 109.258 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 24' ' ' ASP . 2.2 t0 -98.22 113.7 25.72 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.502 1.126 . . . . 2.7200000000000002 109.272 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.526 ' HB3' ' O ' ' A' ' 49' ' ' ALA . 58.5 t-20 -78.16 102.19 7.42 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.524 1.14 . . . . 0.64000000000000001 109.249 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.7 3.52 81.38 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.452 1.095 . . . . 0.75 110.985 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.13 -161.76 0.58 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.342 -0.985 . . . . 1.45 108.342 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.463 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -130.5 21.22 5.15 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 2.6600000000000001 109.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.428 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -153.31 147.55 25.75 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.469 1.106 . . . . 3.4300000000000002 110.357 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.8 m -59.47 127.87 34.21 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.492 1.12 . . . . 1.9399999999999999 110.392 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.557 HG22 HH12 ' A' ' 72' ' ' ARG . 15.9 m -141.87 154.06 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.513 1.133 . . . . 1.78 109.329 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.428 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 1.8 m -101.73 141.19 34.97 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.524 1.14 . . . . 1.8200000000000001 110.425 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.457 HG23 ' CB ' ' A' ' 23' ' ' ALA . 1.8 m -129.93 170.69 18.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.445 1.091 . . . . 2.1400000000000001 109.345 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.508 ' O ' ' CG ' ' A' ' 34' ' ' LYS . 2.0 ptmt -160.64 89.46 0.82 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.504 1.128 . . . . 3.3100000000000001 109.289 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.524 ' CG1' ' CG ' ' A' ' 58' ' ' ASP . 0.8 OUTLIER -40.03 139.01 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 1.8100000000000001 109.35 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.542 ' O ' ' N ' ' A' ' 68' ' ' ARG . 75.0 t -118.03 117.29 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.531 1.144 . . . . 2.04 109.282 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.584 ' CE2' ' HB3' ' A' ' 64' ' ' HIS . 78.4 m-85 -73.64 166.55 23.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 1.9099999999999999 110.984 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -5.59 33.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.505 1.128 . . . . 3.27 110.297 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.4 9.4 31.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.424 1.077 . . . . 2.6200000000000001 109.337 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.459 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 78.52 -1.25 2.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.479 1.112 . . . . 3.9300000000000002 109.293 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.2 p -83.2 167.63 17.54 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.539 1.149 . . . . 2.3399999999999999 110.395 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.411 ' HA ' ' HA ' ' A' ' 36' ' ' VAL . 16.3 mt-10 -134.54 170.28 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.475 1.109 . . . . 2.1699999999999999 110.306 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -83.83 -115.57 0.63 Allowed Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.554 1.159 . . . . 2.0 111.017 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.425 ' O ' ' CD2' ' A' ' 46' ' ' TYR . 36.1 mt -148.44 147.58 29.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.501 0.766 . . . . 2.6800000000000002 109.299 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.428 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.4 OUTLIER -47.2 120.33 3.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 1.112 . . . . 2.1299999999999999 108.285 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.671 ' CD2' ' CG1' ' A' ' 56' ' ' VAL . 6.1 m-85 -137.22 108.05 6.65 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.141 . . . . 2.6600000000000001 110.973 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.27 134.61 34.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 1.5600000000000001 109.255 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.476 ' CG2' ' HB ' ' A' ' 54' ' ' THR . 49.7 t -133.11 141.74 43.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.448 1.092 . . . . 1.52 109.302 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.526 ' O ' ' HB3' ' A' ' 25' ' ' ASN . . . -80.78 167.08 35.13 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.474 1.109 . . . . 1.77 109.291 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.463 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.1 Cg_endo -75.09 117.98 5.08 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.514 1.797 . . . . 0.95999999999999996 110.954 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.6 28.76 18.25 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.492 1.12 . . . . 1.02 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.442 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -132.16 167.18 20.21 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.483 0.755 . . . . 2.4500000000000002 110.297 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -135.75 125.11 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 1.97 109.284 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.476 ' HB ' ' CG2' ' A' ' 48' ' ' VAL . 0.4 OUTLIER -125.78 137.23 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.124 . . . . 1.97 110.381 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.428 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 6.1 m -82.03 127.65 33.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.487 1.117 . . . . 2.1600000000000001 110.431 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.671 ' CG1' ' CD2' ' A' ' 46' ' ' TYR . 3.6 m -95.83 -51.97 10.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.522 1.138 . . . . 3.21 109.36 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.616 ' HA2' ' CD1' ' A' ' 20' ' ' TYR . . . 119.63 89.6 1.2 Allowed Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.517 1.136 . . . . 3.1099999999999999 110.993 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.524 ' CG ' ' CG1' ' A' ' 35' ' ' VAL . 7.7 m-20 -170.24 126.32 0.79 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.508 0.77 . . . . 6.1799999999999997 109.354 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.49 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -131.76 162.27 23.8 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.494 1.121 . . . . 2.1600000000000001 110.993 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.717 ' CD1' HG21 ' A' ' 61' ' ' ILE . 42.6 p90 -95.54 -6.94 39.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 0.762 . . . . 2.46 111.023 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.717 HG21 ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -96.98 12.09 4.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.484 1.115 . . . . 3.1099999999999999 109.269 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -100.98 -173.7 29.02 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.472 1.107 . . . . 3.8399999999999999 110.949 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 p -90.89 -13.23 34.01 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 0.782 . . . . 5.3799999999999999 109.988 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.584 ' HB3' ' CE2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -79.43 1.49 25.29 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.511 1.132 . . . . 2.6699999999999999 109.553 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 -142.88 22.83 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.479 1.112 . . . . 1.03 110.978 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.579 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -116.45 165.08 13.63 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.507 0.769 . . . . 1.4299999999999999 109.575 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.446 ' CB ' ' OE1' ' A' ' 16' ' ' GLN . . . -83.01 121.6 27.22 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.561 1.163 . . . . 1.8400000000000001 109.321 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -75.74 -46.3 31.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.419 1.075 . . . . 5.1600000000000001 110.273 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 17.9 p90 178.92 161.74 0.72 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.494 1.121 . . . . 2.79 111.002 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.469 ' O ' ' N ' ' A' ' 8' ' ' ALA . 17.4 mt -81.57 139.96 34.76 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.5 1.125 . . . . 2.5099999999999998 109.311 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.481 ' CB ' ' HG2' ' A' ' 34' ' ' LYS . . . -117.22 132.06 56.72 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.482 1.114 . . . . 1.8700000000000001 109.319 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.557 HH12 HG22 ' A' ' 31' ' ' VAL . 3.9 mmt180 -63.5 144.87 56.62 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 6.8899999999999997 110.295 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.426 ' C ' ' CD2' ' A' ' 74' ' ' LEU . 50.9 t -126.4 143.86 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.547 1.155 . . . . 2.73 108.276 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.426 ' CD2' ' C ' ' A' ' 73' ' ' CYS . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 116.98 -1.486 . . . . 5.5999999999999996 109.29 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.407 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.317 -0.623 . . . . 14.33 109.317 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.407 ' OG1' ' C ' ' A' ' 1' ' ' ASP . 2.2 p 43.52 -167.63 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 12.51 110.393 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 179.55 55.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.127 . . . . 8.0399999999999991 110.384 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.447 ' O ' ' N ' ' A' ' 6' ' ' GLU . 7.0 t -82.06 78.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 9.1999999999999993 109.298 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m 46.98 -94.41 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.5 1.125 . . . . 3.8399999999999999 109.988 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 4' ' ' VAL . 1.2 mt-10 176.82 95.32 0.11 Allowed Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.529 1.143 . . . . 4.3399999999999999 110.278 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 134.73 18.24 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.524 1.802 . . . . 0.78000000000000003 111.024 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -58.37 166.75 2.04 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.496 1.122 . . . . 1.6000000000000001 109.322 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.622 ' HB3' HH21 ' A' ' 72' ' ' ARG . 18.3 Cg_endo -75.05 176.1 10.37 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.509 1.794 . . . . 0.90000000000000002 111.027 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 t -92.2 13.99 17.52 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.479 1.112 . . . . 3.5499999999999998 110.0 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 7.4 p -99.94 -18.23 17.18 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.5 1.125 . . . . 1.1599999999999999 108.29 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.449 ' CG1' HD11 ' A' ' 70' ' ' LEU . 1.4 t -97.77 117.9 43.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.548 1.155 . . . . 2.5600000000000001 109.303 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.421 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -86.98 139.55 30.48 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.461 1.101 . . . . 2.1499999999999999 110.39 179.995 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.513 ' CD1' HD22 ' A' ' 70' ' ' LEU . 10.3 tp -96.86 114.12 25.72 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 2.02 109.283 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.8 OUTLIER -106.97 70.37 0.8 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 1.77 111.002 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.717 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 24.9 tt0 -78.6 127.8 32.62 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 1.55 110.317 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.596 ' O ' ' CE2' ' A' ' 60' ' ' TYR . 1.7 p -110.8 -151.63 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.52 1.138 . . . . 1.77 109.985 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 60' ' ' TYR . 28.1 p-90 -97.5 -47.49 5.64 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.524 1.14 . . . . 2.4900000000000002 108.026 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -37.55 55.29 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.128 . . . . 6.9699999999999998 110.278 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.547 ' C ' ' O ' ' A' ' 58' ' ' ASP . 6.4 p90 -166.22 -177.06 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.561 1.163 . . . . 7.7199999999999998 110.981 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.508 ' O ' ' CG2' ' A' ' 55' ' ' THR . 27.4 t -117.97 164.07 15.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 3.6499999999999999 109.968 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -138.41 130.34 28.23 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 2.3599999999999999 110.286 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -95.1 119.37 33.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 1.6200000000000001 109.301 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD2' ' OG1' ' A' ' 13' ' ' THR . 2.1 t0 -97.68 115.59 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 2.25 109.26 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' A' ' 49' ' ' ALA . 38.3 t-20 -77.59 84.56 3.95 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.474 1.109 . . . . 0.85999999999999999 109.269 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.78 15.7 59.96 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.502 1.127 . . . . 0.69999999999999996 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.413 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -93.78 11.35 29.52 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.313 -0.995 . . . . 2.7599999999999998 108.313 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.5 32.45 0.09 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 3.2200000000000002 109.321 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.456 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.7 OUTLIER -158.01 133.72 9.07 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.555 1.159 . . . . 2.5899999999999999 110.321 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 3.0 m -50.23 119.33 3.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 2.2200000000000002 110.377 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.4 m -145.82 163.68 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.456 1.098 . . . . 1.6299999999999999 109.304 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 23.3 m -117.66 146.63 43.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.535 1.147 . . . . 1.53 110.409 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.1 m -142.31 176.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.512 1.133 . . . . 1.6699999999999999 109.308 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.452 ' CG ' ' O ' ' A' ' 71' ' ' ALA . 0.7 OUTLIER -160.19 103.56 1.45 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 3.3500000000000001 109.338 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.587 ' CG2' ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -60.44 137.03 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 1.7 109.341 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.581 ' HB ' ' CD1' ' A' ' 69' ' ' TYR . 13.0 t -116.64 124.23 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 2.4700000000000002 109.275 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.664 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 54.6 m-85 -76.26 166.71 23.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.466 1.104 . . . . 1.73 111.03 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.572 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 1.2 tt0 -61.42 -14.38 27.79 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 3.6200000000000001 110.29 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.415 ' OD1' ' O ' ' A' ' 64' ' ' HIS . 0.0 OUTLIER -84.87 7.93 19.23 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 1.97 109.265 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 t0 71.92 6.21 5.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.09 . . . . 3.9300000000000002 109.278 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.435 ' OG1' ' HB2' ' A' ' 37' ' ' TYR . 42.5 p -87.35 151.3 23.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 1.77 110.409 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.471 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 4.6 mt-10 -118.52 141.42 48.58 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.512 1.132 . . . . 1.9399999999999999 110.338 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.499 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -65.89 -94.54 0.03 OUTLIER Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.475 1.109 . . . . 1.77 111.0 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.499 ' CD2' ' O ' ' A' ' 43' ' ' GLY . 50.8 mt -153.84 139.86 18.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.554 0.797 . . . . 2.3100000000000001 109.333 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 113.91 8.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.505 1.128 . . . . 1.6299999999999999 108.324 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -124.03 138.47 54.44 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 1.138 . . . . 2.4300000000000002 111.019 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -96.09 115.6 27.68 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.506 1.129 . . . . 1.8999999999999999 109.318 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.525 ' CG1' ' O ' ' A' ' 52' ' ' GLN . 96.5 t -99.72 131.94 46.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 O-C-N 124.511 1.132 . . . . 1.6899999999999999 109.36 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.457 ' O ' ' ND2' ' A' ' 25' ' ' ASN . . . -68.44 171.97 5.19 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 2.3599999999999999 109.334 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.456 ' HB3' ' N ' ' A' ' 29' ' ' GLU . 18.3 Cg_endo -74.99 111.54 3.35 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.5 1.789 . . . . 1.6799999999999999 110.981 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.33 21.58 44.31 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.52 1.137 . . . . 0.78000000000000003 111.016 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.525 ' O ' ' CG1' ' A' ' 48' ' ' VAL . 0.3 OUTLIER -123.03 155.27 37.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.514 0.773 . . . . 3.6200000000000001 110.268 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.472 ' N ' ' CD ' ' A' ' 52' ' ' GLN . 0.6 OUTLIER -122.36 129.49 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.529 1.143 . . . . 2.5099999999999998 109.328 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.439 ' HB ' ' CG2' ' A' ' 48' ' ' VAL . 0.3 OUTLIER -126.92 138.6 53.32 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.459 1.099 . . . . 1.55 110.425 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.534 ' CG2' ' CD1' ' A' ' 20' ' ' TYR . 2.0 m -78.41 139.48 38.75 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 1.71 110.347 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 3.6 m -113.51 -50.49 5.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.548 1.155 . . . . 2.4300000000000002 109.291 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.42 ' O ' HG12 ' A' ' 35' ' ' VAL . . . 132.53 123.14 2.41 Favored Glycine 0 CA--C 1.531 1.037 0 O-C-N 124.471 1.107 . . . . 2.8999999999999999 110.962 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.664 ' OD1' ' CE2' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 165.78 127.13 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.536 0.786 . . . . 7.0300000000000002 109.278 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -147.52 123.42 1.73 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.51 1.131 . . . . 2.4399999999999999 110.983 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB2' ' CE1' ' A' ' 66' ' ' HIS . 15.2 p90 -70.39 1.87 4.52 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.48 0.753 . . . . 2.98 111.008 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.511 ' CG2' ' O ' ' A' ' 18' ' ' TRP . 9.6 tt -110.94 38.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.461 1.101 . . . . 5.6900000000000004 109.316 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -139.45 -174.38 13.58 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.516 1.135 . . . . 3.5800000000000001 111.003 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.9 p -91.27 -6.24 53.52 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.531 0.783 . . . . 5.6100000000000003 110.001 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.611 ' HB3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -81.51 3.92 23.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.139 . . . . 2.8399999999999999 109.605 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.99 -148.36 37.82 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.505 1.128 . . . . 1.1899999999999999 111.002 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 60' ' ' TYR . 1.7 m170 -120.53 135.73 54.99 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.482 0.754 . . . . 1.76 109.611 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.717 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -36.73 134.59 0.48 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 1.6899999999999999 109.329 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.572 ' CD ' ' HA ' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -91.49 -47.24 7.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.473 1.108 . . . . 5.6600000000000001 110.269 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.581 ' CD1' ' HB ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -178.11 173.95 1.42 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 3.3799999999999999 110.993 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.587 ' CD2' ' CG2' ' A' ' 35' ' ' VAL . 4.5 mt -96.85 144.78 26.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.486 1.117 . . . . 2.5499999999999998 109.249 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.452 ' O ' ' CG ' ' A' ' 34' ' ' LYS . . . -125.94 129.58 49.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.494 1.121 . . . . 1.6299999999999999 109.289 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.622 HH21 ' HB3' ' A' ' 9' ' ' PRO . 4.5 ptp180 -85.57 141.74 29.63 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.53 1.144 . . . . 4.6399999999999997 110.316 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -4.37 50.45 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 2.1899999999999999 108.305 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.0 -1.476 . . . . 6.5300000000000002 109.314 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 2' ' ' THR . 4.2 p-10 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.317 -0.623 . . . . 13.06 109.317 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.442 ' N ' ' OD1' ' A' ' 1' ' ' ASP . 2.4 p -153.52 -97.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.489 1.118 . . . . 13.02 110.403 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.6 m -116.78 -152.52 0.51 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.498 1.124 . . . . 8.5299999999999994 110.41 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.6 p -113.81 38.07 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.459 1.099 . . . . 7.4800000000000004 109.308 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 m -110.23 -174.83 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 3.23 110.011 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -140.94 132.45 13.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.536 1.147 . . . . 3.0 110.238 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 138.37 22.88 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.512 1.796 . . . . 0.80000000000000004 110.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -53.68 170.09 0.31 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 1.8799999999999999 109.309 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.448 ' HG2' ' CG2' ' A' ' 12' ' ' VAL . 18.2 Cg_endo -75.03 167.46 26.98 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.474 1.776 . . . . 1.1699999999999999 110.977 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 45.5 p -85.06 7.67 20.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.517 1.136 . . . . 3.3199999999999998 110.008 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.464 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 6.1 p -114.76 29.79 7.78 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 1.01 108.255 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.448 ' CG2' ' HG2' ' A' ' 9' ' ' PRO . 89.1 t -143.25 109.66 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.536 1.148 . . . . 1.79 109.299 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.43 153.79 29.43 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 1.76 110.436 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.48 HD12 ' CG2' ' A' ' 35' ' ' VAL . 15.1 tp -105.23 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.443 1.09 . . . . 1.9299999999999999 109.327 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -88.64 57.27 4.11 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.541 1.15 . . . . 2.4199999999999999 110.946 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.522 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 25.6 tt0 -76.26 100.71 5.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 1.6699999999999999 110.3 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.627 ' O ' ' CE1' ' A' ' 60' ' ' TYR . 1.4 p -77.79 -150.41 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.445 1.091 . . . . 1.71 109.984 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.71 ' O ' HG12 ' A' ' 61' ' ' ILE . 34.6 p-90 -98.45 -65.18 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.045 -1.094 . . . . 2.54 108.045 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.595 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -93.1 16.68 12.33 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.486 1.116 . . . . 6.96 110.329 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.612 ' CD2' ' CG2' ' A' ' 55' ' ' THR . 0.0 OUTLIER -168.71 161.62 11.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 5.3399999999999999 110.984 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.486 ' OG ' ' C ' ' A' ' 57' ' ' GLY . 65.1 p -143.28 135.6 27.16 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 3.1600000000000001 110.027 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -135.25 177.87 7.47 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.507 1.129 . . . . 2.8999999999999999 110.314 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.23 133.72 39.28 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.524 1.14 . . . . 1.8999999999999999 109.266 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.472 ' HA ' ' CG1' ' A' ' 53' ' ' ILE . 39.8 t0 -103.29 130.44 50.56 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 2.29 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.5 ' CB ' ' O ' ' A' ' 49' ' ' ALA . 23.7 t-20 -84.4 96.87 9.21 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.444 1.09 . . . . 0.80000000000000004 109.285 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -86.47 2.01 87.36 Favored Glycine 0 CA--C 1.529 0.968 0 O-C-N 124.53 1.144 . . . . 0.64000000000000001 111.023 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.464 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -88.94 -157.76 0.46 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.272 -1.01 . . . . 1.6200000000000001 108.272 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.414 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -131.1 16.29 5.1 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 2.0299999999999998 109.315 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -144.14 152.15 40.53 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.562 1.164 . . . . 2.9900000000000002 110.285 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 90.7 m -71.48 130.8 42.19 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.528 1.143 . . . . 1.9199999999999999 110.392 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.8 m -141.46 164.0 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.467 1.105 . . . . 2.0899999999999999 109.294 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.415 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 74.9 m -113.25 141.44 46.99 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 1.6899999999999999 110.415 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 1.2 m -137.74 174.17 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.468 1.105 . . . . 1.7 109.282 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.444 ' CG ' ' O ' ' A' ' 71' ' ' ALA . 5.3 pttt -155.33 105.21 2.47 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 3.1499999999999999 109.316 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.52 ' HB ' ' CG2' ' A' ' 56' ' ' VAL . 0.4 OUTLIER -58.27 115.65 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.516 1.135 . . . . 1.72 109.248 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.503 ' O ' ' N ' ' A' ' 68' ' ' ARG . 99.2 t -98.85 119.3 46.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 1.8200000000000001 109.277 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.623 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 68.7 m-85 -78.61 170.05 17.26 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 1.79 110.998 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.484 ' HG3' ' CG ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -68.05 -12.45 60.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.527 1.142 . . . . 4.46 110.297 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.3 16.62 7.13 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.504 1.128 . . . . 1.8 109.285 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.2 t0 65.22 10.68 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 3.9199999999999999 109.306 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.583 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 0.1 OUTLIER -83.99 155.07 22.95 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.547 1.154 . . . . 2.7000000000000002 110.381 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.404 ' HG2' ' CG2' ' A' ' 36' ' ' VAL . 13.0 mt-10 -133.33 127.07 32.75 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.485 1.116 . . . . 2.3300000000000001 110.273 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.502 ' O ' ' CD2' ' A' ' 44' ' ' LEU . . . -52.29 -105.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.496 1.123 . . . . 1.79 110.989 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.598 ' O ' ' CD2' ' A' ' 46' ' ' TYR . 49.9 mt -153.23 138.06 17.09 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.442 0.731 . . . . 2.46 109.302 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.415 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.1 OUTLIER -55.05 112.08 0.98 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.529 1.143 . . . . 1.4199999999999999 108.282 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.598 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 35.2 m-85 -121.74 123.71 42.48 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.525 1.141 . . . . 2.3900000000000001 110.983 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.45 120.18 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.53 1.144 . . . . 1.5700000000000001 109.3 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.4 t -115.9 142.7 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.495 1.122 . . . . 1.6599999999999999 109.331 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.5 ' O ' ' CB ' ' A' ' 25' ' ' ASN . . . -86.31 169.47 15.18 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.554 1.159 . . . . 1.45 109.352 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.414 ' HB3' ' CA ' ' A' ' 28' ' ' ALA . 18.3 Cg_endo -75.0 104.84 1.97 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.517 1.798 . . . . 0.87 111.02 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.86 34.78 2.93 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.494 1.121 . . . . 0.76000000000000001 111.022 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -152.33 158.08 42.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.461 0.741 . . . . 2.3399999999999999 110.276 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.472 ' CG1' ' HA ' ' A' ' 24' ' ' ASP . 8.0 mt -126.21 153.33 34.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.478 1.111 . . . . 3.8799999999999999 109.294 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.448 ' C ' ' HB3' ' A' ' 22' ' ' GLN . 0.5 OUTLIER -153.65 142.94 21.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.459 1.099 . . . . 1.8799999999999999 110.401 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.612 ' CG2' ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -62.84 142.89 58.04 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 1.8 110.391 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.52 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 4.4 m -122.92 -7.28 8.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 2.0499999999999998 109.29 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.486 ' C ' ' OG ' ' A' ' 21' ' ' SER . . . 159.48 -156.17 27.3 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.485 1.115 . . . . 2.3799999999999999 111.027 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.443 ' HA ' ' HA ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -91.65 179.0 5.76 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 0.773 . . . . 6.21 109.304 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.472 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -89.45 -145.43 12.25 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.542 1.151 . . . . 2.1699999999999999 110.959 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.627 ' CE1' ' O ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -98.46 -1.2 41.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.491 0.76 . . . . 3.52 110.968 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.71 HG12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -107.32 37.13 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.472 1.107 . . . . 5.0899999999999999 109.341 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -125.75 -164.23 11.76 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.454 1.097 . . . . 4.4299999999999997 110.987 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.9 m -91.51 -5.0 54.88 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.526 0.78 . . . . 4.29 110.019 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.623 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 6.1 m-70 -100.01 39.14 1.36 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.118 . . . . 3.0699999999999998 109.604 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 45.84 -137.61 7.35 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.49 1.118 . . . . 1.3 111.01 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.529 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.8 OUTLIER -121.27 123.49 42.33 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.522 0.778 . . . . 1.3899999999999999 109.56 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.522 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -43.06 117.76 1.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 1.6599999999999999 109.306 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -76.62 -40.9 47.9 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 5.0 110.326 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 12.5 p90 -178.24 -170.21 0.22 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.541 1.15 . . . . 1.8300000000000001 110.959 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.467 HD22 ' CG2' ' A' ' 35' ' ' VAL . 51.8 mt -114.64 134.5 55.02 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.516 1.135 . . . . 2.2599999999999998 109.329 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.444 ' O ' ' CG ' ' A' ' 34' ' ' LYS . . . -113.92 130.0 56.55 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.478 1.111 . . . . 1.8200000000000001 109.297 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.428 HH21 ' HB3' ' A' ' 9' ' ' PRO . 3.3 ptp180 -86.49 138.69 31.54 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 5.8700000000000001 110.276 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 113.34 25.4 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.486 1.116 . . . . 2.7599999999999998 108.295 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.535 ' N ' ' CD1' ' A' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 116.97 -1.491 . . . . 6.3600000000000003 109.275 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.313 -0.625 . . . . 14.81 109.313 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -175.91 -60.62 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.519 1.137 . . . . 11.800000000000001 110.366 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' THR . . . . . 0.421 ' OG1' ' N ' ' A' ' 4' ' ' VAL . 11.0 t 43.76 -163.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.464 1.103 . . . . 9.6999999999999993 110.413 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.421 ' N ' ' OG1' ' A' ' 3' ' ' THR . 7.8 m -130.46 135.11 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.505 1.128 . . . . 10.140000000000001 109.28 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.419 ' CB ' ' OH ' ' A' ' 69' ' ' TYR . 1.9 m 53.7 -146.41 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.484 1.115 . . . . 4.7599999999999998 110.013 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.533 ' O ' ' CB ' ' A' ' 71' ' ' ALA . 1.3 tt0 -149.54 106.5 3.3 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.45 1.094 . . . . 3.73 110.267 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 142.93 28.56 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.538 1.81 . . . . 0.82999999999999996 111.031 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.482 ' CB ' ' CD ' ' A' ' 9' ' ' PRO . . . -74.43 179.81 1.2 Allowed Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.482 1.114 . . . . 2.1600000000000001 109.296 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.482 ' CD ' ' CB ' ' A' ' 8' ' ' ALA . 18.4 Cg_endo -74.94 165.19 31.88 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.545 1.813 . . . . 1.1000000000000001 111.018 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.7 m -90.47 16.26 9.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.554 1.159 . . . . 3.1000000000000001 110.006 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.455 ' O ' ' N ' ' A' ' 26' ' ' GLY . 26.6 p -108.43 12.28 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.493 1.121 . . . . 0.90000000000000002 108.293 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 75.4 t -128.07 117.57 46.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 1.6699999999999999 109.288 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.42 ' OG1' ' OD2' ' A' ' 24' ' ' ASP . 0.3 OUTLIER -81.34 145.45 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 2.27 110.386 179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.489 HD12 ' CG2' ' A' ' 35' ' ' VAL . 43.9 tp -101.63 105.46 16.4 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 2.02 109.326 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.547 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -98.08 65.91 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 2.02 110.999 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.693 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 6.7 tt0 -79.5 118.27 21.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.449 1.093 . . . . 1.46 110.312 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -100.84 -157.55 0.62 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.505 1.128 . . . . 1.9299999999999999 110.007 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.574 ' CZ3' ' HB3' ' A' ' 19' ' ' ARG . 62.9 p-90 -96.06 -45.35 6.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.522 1.139 . . . . 2.3100000000000001 107.991 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 17.9 ptt180 -77.53 -37.02 51.78 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.45 1.094 . . . . 8.0099999999999998 110.31 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.634 ' CD2' ' HA2' ' A' ' 57' ' ' GLY . 0.3 OUTLIER -164.6 173.7 11.67 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 7.1900000000000004 111.01 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.51 ' O ' ' CG2' ' A' ' 55' ' ' THR . 54.4 p -116.75 158.12 24.38 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 3.3100000000000001 109.992 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.547 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 0.6 OUTLIER -142.76 134.44 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.475 1.109 . . . . 3.0499999999999998 110.315 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -98.01 128.68 44.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 1.9099999999999999 109.282 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.435 ' HA ' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -106.22 120.4 41.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.547 1.155 . . . . 2.48 109.32 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.485 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 60.6 t-20 -77.81 89.98 4.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.549 1.155 . . . . 0.56000000000000005 109.286 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -83.98 8.16 67.8 Favored Glycine 0 CA--C 1.531 1.036 0 O-C-N 124.527 1.142 . . . . 0.76000000000000001 110.989 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.65 -156.36 0.24 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.314 -0.995 . . . . 1.8 108.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.35 18.84 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.51 1.131 . . . . 1.8200000000000001 109.279 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.412 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 6.2 mt-10 -155.85 135.05 12.19 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.119 . . . . 1.99 110.241 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.5 m -41.67 124.83 2.62 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 1.5800000000000001 110.406 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 17.5 m -139.35 154.8 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 2.3599999999999999 109.292 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.493 HG23 ' SG ' ' A' ' 45' ' ' CYS . 30.7 m -108.09 146.18 33.0 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 1.77 110.378 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.519 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 2.6 m -138.16 172.01 14.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.54 1.15 . . . . 2.1099999999999999 109.278 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.4 ' HD3' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -162.01 101.11 1.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.468 1.105 . . . . 3.8599999999999999 109.279 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.517 ' CG2' HD22 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -59.98 133.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.457 1.098 . . . . 1.8500000000000001 109.344 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 68' ' ' ARG . 90.6 t -113.22 124.68 70.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 1.8999999999999999 109.296 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.638 ' CZ ' ' OD1' ' A' ' 58' ' ' ASP . 11.7 m-85 -75.83 166.35 23.65 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.446 1.092 . . . . 2.2599999999999998 111.025 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.408 ' O ' ' OE1' ' A' ' 38' ' ' GLU . 1.7 tm-20 -72.26 -8.01 52.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.143 . . . . 3.4199999999999999 110.308 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -95.69 10.13 37.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.524 1.14 . . . . 2.0299999999999998 109.251 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 80.78 8.47 1.21 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 4.9800000000000004 109.294 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.41 ' OG1' ' HB2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -79.77 166.71 21.48 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.514 1.134 . . . . 2.7799999999999998 110.429 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . 0.401 ' OE1' HG21 ' A' ' 36' ' ' VAL . 2.4 mt-10 -131.93 153.11 50.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.516 1.135 . . . . 3.25 110.308 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 35' ' ' VAL . . . -99.38 33.31 6.28 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.463 1.102 . . . . 3.3900000000000001 110.966 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 46' ' ' TYR . 0.5 OUTLIER 60.35 151.8 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.51 0.77 . . . . 3.4199999999999999 109.327 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 1.022 ' SG ' ' SG ' ' A' ' 73' ' ' CYS . 0.0 OUTLIER -85.26 141.54 30.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.521 1.138 . . . . 2.77 108.253 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.594 ' CD1' ' O ' ' A' ' 45' ' ' CYS . 27.7 m-85 -150.29 135.71 18.07 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.49 1.118 . . . . 3.1600000000000001 110.995 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.46 141.73 28.41 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 2.2400000000000002 109.277 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.485 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 44.2 t -137.15 134.06 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.134 . . . . 1.98 109.321 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -71.83 166.44 40.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 1.6100000000000001 109.325 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.412 ' HB3' ' N ' ' A' ' 29' ' ' GLU . 18.3 Cg_endo -75.02 113.96 3.91 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.503 1.791 . . . . 0.81000000000000005 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.72 8.57 54.25 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.512 1.133 . . . . 0.79000000000000004 111.024 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.12 161.85 17.83 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.539 0.788 . . . . 2.4700000000000002 110.324 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.531 ' CG2' ' HG2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -128.7 148.32 33.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 3.1600000000000001 109.299 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.45 ' HB ' ' CG2' ' A' ' 48' ' ' VAL . 0.4 OUTLIER -150.38 136.29 18.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 2.1299999999999999 110.399 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.51 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.4 m -74.75 138.4 42.68 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.523 1.139 . . . . 1.8600000000000001 110.43 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 10.5 m -110.45 -51.28 6.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.501 1.125 . . . . 2.3700000000000001 109.323 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.634 ' HA2' ' CD2' ' A' ' 20' ' ' TYR . . . 133.09 117.4 1.82 Allowed Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.513 1.133 . . . . 3.0800000000000001 110.993 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.638 ' OD1' ' CZ ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 162.6 130.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.528 0.781 . . . . 6.9400000000000004 109.276 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -144.75 116.38 0.93 Allowed Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.49 1.119 . . . . 2.4500000000000002 110.942 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.726 ' O ' ' CG ' ' A' ' 60' ' ' TYR . 0.5 OUTLIER -78.99 50.38 1.02 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.474 0.749 . . . . 2.7999999999999998 111.03 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.503 ' CG2' ' HB2' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -84.54 -18.06 9.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 3.8900000000000001 109.34 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.79 10.54 20.97 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 124.512 1.133 . . . . 4.6900000000000004 110.938 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -90.54 -77.76 0.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 0.771 . . . . 4.4199999999999999 110.001 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.45 ' ND1' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -89.72 25.91 1.91 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.465 1.103 . . . . 3.9199999999999999 109.595 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.475 ' C ' ' CD2' ' A' ' 66' ' ' HIS . . . 76.14 -144.45 30.91 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.483 1.114 . . . . 1.52 110.95 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.565 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -131.79 135.43 46.76 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.503 0.766 . . . . 1.4299999999999999 109.567 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.693 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -38.82 128.95 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.547 1.154 . . . . 1.47 109.277 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' A' ' 36' ' ' VAL . 2.1 ttt180 -77.34 -49.27 15.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 6.71 110.333 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.419 ' OH ' ' CB ' ' A' ' 5' ' ' SER . 13.0 p90 -176.01 173.48 2.25 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.535 1.147 . . . . 2.46 111.031 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.517 HD22 ' CG2' ' A' ' 35' ' ' VAL . 7.7 mt -96.24 135.98 37.33 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.499 1.124 . . . . 2.0600000000000001 109.277 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.533 ' CB ' ' O ' ' A' ' 6' ' ' GLU . . . -117.18 163.37 16.39 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.461 1.101 . . . . 1.77 109.317 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HG3' ' CG ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -114.81 136.85 52.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.522 1.139 . . . . 3.9300000000000002 110.249 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 1.022 ' SG ' ' SG ' ' A' ' 45' ' ' CYS . 1.4 t -78.41 -17.93 55.71 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.497 1.123 . . . . 2.23 108.263 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HB2' ' NH1' ' A' ' 72' ' ' ARG . 4.6 mt . . . . . 0 C--O 1.25 1.105 0 CA-C-O 116.95 -1.5 . . . . 6.79 109.325 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.318 -0.623 . . . . 12.24 109.318 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 t -110.04 -38.16 5.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.479 1.112 . . . . 10.48 110.413 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.5 m -144.24 108.55 4.81 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.513 1.133 . . . . 7.6500000000000004 110.423 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.486 ' O ' ' CB ' ' A' ' 5' ' ' SER . 1.1 p -68.21 -161.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.512 1.133 . . . . 7.7999999999999998 109.319 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.486 ' CB ' ' O ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER 84.07 -73.61 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 4.0999999999999996 110.045 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.511 ' O ' ' CB ' ' A' ' 71' ' ' ALA . 0.1 OUTLIER 82.71 120.41 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.5 1.125 . . . . 3.3399999999999999 110.332 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 139.52 24.41 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.531 1.806 . . . . 0.63 111.013 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.429 ' HA ' ' CG ' ' A' ' 72' ' ' ARG . . . -53.83 164.07 1.0 Allowed Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.12 . . . . 1.6100000000000001 109.34 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.467 ' HD3' ' CD ' ' A' ' 72' ' ' ARG . 18.1 Cg_endo -75.02 172.13 16.97 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.424 1.749 . . . . 0.89000000000000001 111.009 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 95.6 p -83.33 8.49 13.42 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 3.4100000000000001 110.034 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 15.7 p -110.14 29.15 7.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.51 1.131 . . . . 1.0 108.315 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 83.1 t -145.18 114.94 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 1.71 109.326 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.6 142.62 28.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.53 1.144 . . . . 2.0800000000000001 110.362 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.467 HD12 ' CG2' ' A' ' 35' ' ' VAL . 20.1 tp -85.47 157.95 20.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.52 1.138 . . . . 2.25 109.29 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -148.97 76.06 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 2.5 111.006 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 28.6 tt0 -79.93 141.5 35.99 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.475 1.11 . . . . 2.2599999999999998 110.296 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' SER . . . . . 0.473 ' O ' ' CD1' ' A' ' 60' ' ' TYR . 81.4 p -115.35 -128.24 0.29 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 2.5899999999999999 109.984 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.671 ' HA ' ' CD1' ' A' ' 60' ' ' TYR . 41.2 p-90 -94.07 -68.4 0.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.561 1.163 . . . . 6.0300000000000002 108.047 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.646 ' HB2' ' CE3' ' A' ' 18' ' ' TRP . 2.1 ttp180 -118.12 37.06 4.11 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.409 1.068 . . . . 9.9800000000000004 110.289 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -177.67 159.25 1.43 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 6.6399999999999997 110.977 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.597 ' CB ' ' HB2' ' A' ' 58' ' ' ASP . 40.4 m -131.77 166.25 21.96 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.464 1.102 . . . . 2.8199999999999998 109.995 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.457 ' N ' ' O ' ' A' ' 15' ' ' TYR . 5.1 tt0 -138.85 140.83 38.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.466 1.104 . . . . 2.5 110.311 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.07 123.26 47.5 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.534 1.147 . . . . 1.6399999999999999 109.339 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -100.17 120.28 39.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.499 1.124 . . . . 2.0800000000000001 109.303 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.479 ' CB ' ' O ' ' A' ' 49' ' ' ALA . 20.2 t-20 -78.7 101.39 7.5 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.48 1.113 . . . . 0.93000000000000005 109.361 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.24 -0.52 76.86 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.493 1.121 . . . . 0.82999999999999996 110.991 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' CYS . . . . . 0.519 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -85.32 -158.66 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.295 -1.002 . . . . 1.5900000000000001 108.295 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.47 ' HA ' ' CB ' ' A' ' 50' ' ' PRO . . . -133.4 28.47 4.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 1.8200000000000001 109.264 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.439 ' N ' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -154.04 150.35 28.14 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.424 1.077 . . . . 3.25 110.309 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.2 m -73.76 127.66 33.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.435 1.085 . . . . 2.3399999999999999 110.38 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.2 m -142.25 166.61 16.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 1.8700000000000001 109.301 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.441 ' CG2' ' SG ' ' A' ' 45' ' ' CYS . 23.3 m -116.12 138.65 51.07 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.114 . . . . 2.02 110.372 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -141.97 172.5 9.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.521 1.138 . . . . 2.2200000000000002 109.267 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.493 ' HG2' ' O ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -148.19 118.06 7.15 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.555 1.159 . . . . 3.1600000000000001 109.288 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.505 ' CG1' ' OD2' ' A' ' 58' ' ' ASP . 0.4 OUTLIER -58.77 146.9 8.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.527 1.142 . . . . 2.0499999999999998 109.308 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.4 ' O ' ' N ' ' A' ' 68' ' ' ARG . 73.4 t -126.79 123.22 62.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.558 1.161 . . . . 1.79 109.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 89.5 m-85 -74.29 163.0 28.34 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.467 1.105 . . . . 2.27 111.014 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.2 OUTLIER -62.52 -12.07 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.512 1.132 . . . . 3.5699999999999998 110.343 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.62 5.5 35.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.484 1.115 . . . . 1.8700000000000001 109.31 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.9 OUTLIER 80.08 -2.91 1.99 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.453 1.096 . . . . 4.21 109.275 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' THR . . . . . 0.407 ' OG1' ' OD2' ' A' ' 39' ' ' ASP . 1.2 p -80.11 172.81 13.28 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.516 1.135 . . . . 2.0899999999999999 110.396 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -140.94 159.73 41.59 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.424 1.078 . . . . 1.8600000000000001 110.303 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -89.79 -99.66 1.09 Allowed Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.563 1.164 . . . . 1.9099999999999999 110.972 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.6 mt -141.24 145.1 35.15 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.513 0.772 . . . . 2.6600000000000001 109.324 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . 0.441 ' SG ' ' CG2' ' A' ' 32' ' ' THR . 0.7 OUTLIER -81.05 131.54 35.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.544 1.153 . . . . 1.8 108.302 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.56 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 28.8 m-85 -138.92 145.34 39.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.102 . . . . 3.02 110.969 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.15 129.83 40.58 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.508 1.13 . . . . 1.5900000000000001 109.278 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.467 ' CG1' ' HB2' ' A' ' 25' ' ' ASN . 50.9 t -124.79 144.93 33.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.489 1.118 . . . . 1.55 109.291 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.479 ' O ' ' CB ' ' A' ' 25' ' ' ASN . . . -89.75 166.76 19.45 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.541 1.151 . . . . 1.77 109.315 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.47 ' CB ' ' HA ' ' A' ' 28' ' ' ALA . 18.2 Cg_endo -74.99 123.18 7.7 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.504 1.792 . . . . 1.1499999999999999 111.013 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.01 21.74 41.16 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 124.527 1.142 . . . . 1.1899999999999999 110.994 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.463 ' C ' ' CD1' ' A' ' 53' ' ' ILE . 0.0 OUTLIER -134.2 169.81 16.62 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.518 0.775 . . . . 2.8900000000000001 110.305 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.463 ' CD1' ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -136.74 138.13 46.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 2.23 109.268 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.467 ' CG2' ' CG2' ' A' ' 48' ' ' VAL . 0.4 OUTLIER -138.11 140.91 40.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.478 1.111 . . . . 2.0299999999999998 110.438 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' THR . . . . . 0.479 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.5 m -84.9 127.31 34.1 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.468 1.105 . . . . 1.72 110.387 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.56 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 3.9 m -101.75 -42.89 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.477 1.11 . . . . 2.6200000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.551 ' O ' ' CB ' ' A' ' 58' ' ' ASP . . . 138.79 159.4 8.03 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.553 1.158 . . . . 2.46 110.985 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.606 ' O ' ' C ' ' A' ' 19' ' ' ARG . 2.4 m-20 152.03 -171.2 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.46 0.741 . . . . 6.4900000000000002 109.291 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.554 ' HA2' ' O ' ' A' ' 18' ' ' TRP . . . 174.73 118.46 0.52 Allowed Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.495 1.122 . . . . 3.0600000000000001 111.008 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.671 ' CD1' ' HA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -101.9 11.75 38.08 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.507 0.769 . . . . 4.9000000000000004 111.057 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ILE . . . . . 0.505 HG21 ' O ' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -72.5 -5.19 5.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.5 1.125 . . . . 4.3799999999999999 109.265 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 118.18 2.09 16.03 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.505 1.128 . . . . 3.9100000000000001 111.016 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.8 m -60.14 -101.2 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 0.77 . . . . 4.0499999999999998 110.044 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.571 ' HB3' ' CD2' ' A' ' 37' ' ' TYR . 0.3 OUTLIER -91.92 27.91 1.98 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.566 1.166 . . . . 4.6600000000000001 109.631 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' GLY . . . 84.31 -140.96 19.51 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.507 1.129 . . . . 1.53 111.009 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.48 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.3 m170 -126.68 131.61 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 0.735 . . . . 2.4100000000000001 109.634 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . 0.427 ' HB3' ' OD2' ' A' ' 58' ' ' ASP . . . -38.47 119.78 0.85 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 1.8799999999999999 109.284 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 38' ' ' GLU . 7.6 ttp85 -78.69 -44.27 24.0 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 5.8799999999999999 110.308 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 69' ' ' TYR . 7.8 p90 -176.43 167.88 2.76 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.517 1.135 . . . . 2.0699999999999998 111.0 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.49 HD22 ' CG2' ' A' ' 35' ' ' VAL . 14.4 mt -101.2 147.29 26.44 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.533 1.146 . . . . 2.6600000000000001 109.329 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 6' ' ' GLU . . . -131.33 149.04 52.72 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.524 1.14 . . . . 2.0800000000000001 109.267 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -88.72 150.73 22.83 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 1.108 . . . . 4.8399999999999999 110.277 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.5 m -115.06 137.03 52.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 2.8300000000000001 108.301 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.899 ' OXT' HD13 ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.113 0 CA-C-O 117.0 -1.476 . . . . 5.8600000000000003 109.294 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.467 ' CG ' ' HD2' ' A' ' 7' ' ' PRO . 4.7 tt0 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 110.322 -0.251 . . . . 3.7400000000000002 110.322 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 6' ' ' GLU . 18.3 Cg_endo -74.99 144.8 30.71 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.507 1.793 . . . . 0.83999999999999997 111.008 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -61.18 173.21 0.75 Allowed Pre-proline 0 C--N 1.326 -0.428 0 O-C-N 124.509 1.131 . . . . 0.66000000000000003 109.325 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -74.99 172.13 16.96 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.526 1.803 . . . . 0.93999999999999995 111.004 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.51 11.16 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 2.1899999999999999 110.037 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 26' ' ' GLY . 7.9 p -108.29 20.75 18.25 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.533 1.146 . . . . 0.97999999999999998 108.261 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.726 HG13 ' O ' ' A' ' 24' ' ' ASP . 43.9 t -138.28 131.46 40.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.565 1.166 . . . . 0.92000000000000004 109.27 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' LEU . 1.1 m -97.92 167.02 11.17 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.498 1.124 . . . . 2.23 110.389 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 1.013 HD13 HD21 ' A' ' 70' ' ' LEU . 14.7 tp -123.76 130.91 53.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.69999999999999996 109.267 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -115.67 70.14 0.74 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 1.125 . . . . 1.29 110.985 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -91.92 102.19 14.76 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.493 1.121 . . . . 1.3999999999999999 110.284 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' CA ' ' A' ' 59' ' ' GLY . 10.5 p -106.68 -152.92 0.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 1.9199999999999999 110.007 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.613 ' O ' HD12 ' A' ' 61' ' ' ILE . 55.7 p-90 -93.35 -27.54 16.71 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.496 1.122 . . . . 2.6299999999999999 107.981 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -77.2 -61.64 1.92 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 6.1900000000000004 110.337 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 2.6 p90 -159.25 177.09 11.4 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.125 . . . . 8.1199999999999992 110.998 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.498 ' O ' HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -106.77 132.97 52.13 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.544 1.153 . . . . 2.1400000000000001 110.036 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.804 ' OE1' HG22 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -120.65 142.9 49.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 2.6000000000000001 110.286 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.741 ' CB ' HG11 ' A' ' 56' ' ' VAL . . . -112.7 123.75 51.0 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.509 1.131 . . . . 0.59999999999999998 109.259 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.726 ' O ' HG13 ' A' ' 12' ' ' VAL . 39.6 t0 -107.47 126.15 52.15 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.469 1.106 . . . . 2.3100000000000001 109.332 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.534 ' CB ' HG12 ' A' ' 48' ' ' VAL . 56.5 t-20 -94.04 89.67 6.12 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.543 1.152 . . . . 0.67000000000000004 109.309 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -81.27 8.34 58.35 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.525 1.14 . . . . 1.02 110.981 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -179.99 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.301 -1.0 . . . . 1.8 108.301 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.444 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -115.49 21.25 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 1.1299999999999999 109.294 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.474 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.5 mt-10 -154.02 137.99 16.34 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.464 1.102 . . . . 2.1299999999999999 110.301 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.417 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.8 m -51.72 130.3 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.533 1.146 . . . . 0.92000000000000004 110.455 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 29' ' ' GLU . 20.9 m -140.29 153.65 22.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 0.68000000000000005 109.287 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.82 HG22 ' SG ' ' A' ' 45' ' ' CYS . 54.8 m -113.15 133.13 55.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.56 1.163 . . . . 0.81000000000000005 110.397 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 1.4 m -135.24 179.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.72999999999999998 109.275 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 13.6 pttm -159.7 108.88 1.81 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.544 1.152 . . . . 2.5699999999999998 109.253 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 1.048 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.59 114.59 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 0.52000000000000002 109.311 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.785 HG22 ' HG2' ' A' ' 42' ' ' GLU . 19.4 t -97.33 121.18 47.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 0.73999999999999999 109.289 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -78.89 178.62 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.489 1.118 . . . . 0.93000000000000005 111.021 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 0.4 OUTLIER -84.61 -9.77 57.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.487 1.117 . . . . 3.2000000000000002 110.273 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.489 ' HB2' ' CG2' ' A' ' 41' ' ' THR . 0.0 OUTLIER -81.59 0.93 36.12 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.546 1.154 . . . . 2.0800000000000001 109.299 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.488 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 81.52 31.0 0.13 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.15 . . . . 3.6800000000000002 109.317 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.489 ' CG2' ' HB2' ' A' ' 39' ' ' ASP . 0.2 OUTLIER -124.44 174.28 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 2.04 110.392 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.785 ' HG2' HG22 ' A' ' 36' ' ' VAL . 1.7 mp0 -135.84 151.24 49.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.511 1.132 . . . . 2.6800000000000002 110.3 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.601 ' O ' ' CE2' ' A' ' 46' ' ' TYR . . . -87.78 46.51 3.45 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 124.55 1.156 . . . . 3.2400000000000002 111.019 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.98 154.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 0.754 . . . . 2.23 109.301 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.82 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.8 OUTLIER -91.1 123.07 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 1.99 108.298 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CE2' ' O ' ' A' ' 43' ' ' GLY . 25.8 m-85 -124.93 137.59 54.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.48 1.112 . . . . 2.3900000000000001 110.971 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.85 130.21 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.117 . . . . 0.70999999999999996 109.277 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.534 HG12 ' CB ' ' A' ' 25' ' ' ASN . 40.6 t -126.81 138.02 56.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.56999999999999995 109.285 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.733 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -81.07 172.9 8.65 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 0.90000000000000002 109.291 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.733 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.08 99.32 1.24 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.522 1.801 . . . . 0.79000000000000004 110.979 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.3 30.13 3.22 Favored Glycine 0 CA--C 1.53 1.001 0 O-C-N 124.496 1.122 . . . . 1.1499999999999999 110.982 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.973 ' O ' HD13 ' A' ' 53' ' ' ILE . 6.0 tt0 -125.49 153.29 43.78 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.465 0.744 . . . . 3.4199999999999999 110.327 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.973 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -139.33 120.77 15.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.51 1.131 . . . . 1.3400000000000001 109.333 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.04 154.66 44.2 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.094 . . . . 1.52 110.415 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -61.88 146.68 49.05 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.526 1.142 . . . . 1.2 110.398 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.741 HG11 ' CB ' ' A' ' 23' ' ' ALA . 29.2 m -139.33 11.12 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.52 1.137 . . . . 2.5699999999999998 109.293 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 170.38 -169.58 42.39 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.457 1.098 . . . . 2.3799999999999999 110.947 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.446 ' C ' ' HA ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -104.42 -170.73 1.81 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.471 0.748 . . . . 5.8499999999999996 109.299 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.427 ' CA ' ' O ' ' A' ' 17' ' ' SER . . . -88.27 175.05 44.2 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.507 1.129 . . . . 1.3400000000000001 110.969 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' ND1' ' A' ' 66' ' ' HIS . 0.6 OUTLIER -94.2 36.04 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.474 0.75 . . . . 2.27 111.022 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 2.6899999999999999 109.283 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.994 0 N-CA-C 111.017 -0.833 . . . . 1.1799999999999999 111.017 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.427 ' ND1' ' HB2' ' A' ' 60' ' ' TYR . 5.3 m-70 -125.15 116.28 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 0.765 . . . . 1.26 109.598 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -40.6 118.63 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.528 1.142 . . . . 0.60999999999999999 109.312 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -78.01 -45.39 23.85 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 5.9900000000000002 110.269 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 68' ' ' ARG . 5.2 p90 177.21 166.94 0.58 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 1.4199999999999999 111.002 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 1.048 ' CD2' HG23 ' A' ' 35' ' ' VAL . 10.9 mt -85.06 136.46 33.56 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.548 1.155 . . . . 1.1799999999999999 109.319 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.554 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.6 138.05 51.72 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.542 1.151 . . . . 0.57999999999999996 109.309 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -81.29 147.19 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.474 1.109 . . . . 3.77 110.306 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 O-C-N 124.484 1.115 . . . . 2.5099999999999998 108.292 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 110.299 -0.26 . . . . 3.2599999999999998 110.299 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.99 149.41 36.71 Favored 'Trans proline' 0 C--N 1.36 1.136 0 O-C-N 124.49 1.784 . . . . 1.1799999999999999 110.954 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -84.77 166.56 31.42 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.133 . . . . 0.69999999999999996 109.316 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.01 173.01 15.26 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.473 1.775 . . . . 0.93000000000000005 110.977 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.1 9.74 29.7 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.539 1.149 . . . . 3.3599999999999999 110.0 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 9' ' ' PRO . 11.8 p -91.05 -36.8 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 2.0899999999999999 108.312 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 33' ' ' VAL . 84.5 t -79.08 115.51 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.63 109.29 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.414 ' OG1' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -83.59 158.12 22.04 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.499 1.124 . . . . 0.97999999999999998 110.404 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.716 HD13 HD21 ' A' ' 70' ' ' LEU . 11.4 tp -113.13 112.22 23.44 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.48 1.113 . . . . 0.68999999999999995 109.292 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.483 ' HB3' ' CB ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -96.19 59.22 1.9 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.518 1.136 . . . . 1.9099999999999999 110.963 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 21' ' ' SER . 6.1 tt0 -78.23 117.83 19.87 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.467 1.104 . . . . 1.52 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.531 ' OG ' ' O ' ' A' ' 20' ' ' TYR . 6.4 p -107.88 -149.36 0.43 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.557 1.16 . . . . 1.1899999999999999 110.001 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.653 ' CE3' ' N ' ' A' ' 19' ' ' ARG . 24.3 p-90 -106.68 -42.81 4.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.499 1.124 . . . . 2.25 108.03 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.653 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -78.31 -33.25 49.42 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 8.1199999999999992 110.339 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.65 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER -167.4 160.08 13.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.136 . . . . 8.4299999999999997 110.979 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.594 ' O ' HG22 ' A' ' 55' ' ' THR . 5.6 m -112.22 144.22 41.99 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.511 1.132 . . . . 2.6200000000000001 110.003 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 1.7 tt0 -126.77 172.75 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.12 . . . . 1.8100000000000001 110.307 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.41 125.15 22.4 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.56 1.163 . . . . 0.60999999999999999 109.273 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' O ' HG13 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -97.89 137.34 36.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 2.5 109.264 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.48 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 34.9 t-20 -95.69 81.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.78000000000000003 109.252 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.84 20.52 27.93 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.502 1.126 . . . . 1.1599999999999999 110.989 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' O ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -94.05 10.11 34.95 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.28 -1.007 . . . . 3.0099999999999998 108.28 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.466 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.88 32.68 0.11 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.448 1.092 . . . . 2.0 109.327 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -163.03 138.68 6.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.52 1.138 . . . . 2.0299999999999998 110.299 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -54.62 118.95 4.61 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.96999999999999997 110.423 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.461 HG13 ' O ' ' A' ' 29' ' ' GLU . 34.2 m -143.88 173.4 5.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.485 1.116 . . . . 0.57999999999999996 109.281 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.424 HG23 ' C ' ' A' ' 46' ' ' TYR . 60.0 m -124.56 141.97 51.69 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 0.71999999999999997 110.424 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -141.91 175.34 5.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.092 . . . . 0.63 109.275 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.992 ' CG ' ' HB3' ' A' ' 71' ' ' ALA . 16.0 ptmt -156.6 112.01 2.9 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 3.0800000000000001 109.309 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -56.48 132.4 20.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 0.53000000000000003 109.26 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.874 HG11 ' CZ ' ' A' ' 69' ' ' TYR . 78.6 t -116.96 118.64 59.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 0.77000000000000002 109.328 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -76.44 166.33 23.57 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.505 1.128 . . . . 0.90000000000000002 111.018 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.486 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.91 -9.77 32.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.53 1.144 . . . . 3.0899999999999999 110.312 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -90.47 19.09 5.51 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.142 . . . . 2.6600000000000001 109.344 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.72 13.72 5.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.471 1.107 . . . . 4.2300000000000004 109.291 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -93.31 161.94 14.2 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.139 . . . . 1.0900000000000001 110.401 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.1 mt-10 -135.52 146.08 47.71 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 2.8100000000000001 110.334 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.71 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -73.14 -92.63 0.11 Allowed Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.475 1.109 . . . . 1.8400000000000001 110.967 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 43' ' ' GLY . 42.4 mt -153.31 144.45 23.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.446 0.733 . . . . 1.25 109.306 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.9 m -75.75 105.5 6.82 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.566 1.166 . . . . 2.2799999999999998 108.327 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.424 ' C ' HG23 ' A' ' 32' ' ' THR . 8.1 m-30 -112.97 142.12 46.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.518 1.136 . . . . 1.99 110.979 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.22 122.8 40.65 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.471 1.107 . . . . 0.42999999999999999 109.31 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 ' HB ' ' A' ' 54' ' ' THR . 74.8 t -113.71 140.68 32.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.513 1.133 . . . . 0.34999999999999998 109.281 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.828 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.8 177.54 2.93 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 0.56000000000000005 109.314 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.828 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.4 Cg_endo -74.99 108.49 2.73 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.486 1.782 . . . . 1.02 111.002 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.66 6.41 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.441 1.088 . . . . 0.73999999999999999 111.027 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.894 ' C ' HD13 ' A' ' 53' ' ' ILE . 12.1 tt0 -134.98 157.84 45.88 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.462 0.742 . . . . 2.2200000000000002 110.34 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.894 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -130.22 137.22 56.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.523 1.139 . . . . 1.0700000000000001 109.286 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.524 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -143.68 143.64 31.52 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 0.79000000000000004 110.445 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.2 131.96 45.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.489 1.118 . . . . 1.2 110.422 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.511 HG23 ' HB ' ' A' ' 35' ' ' VAL . 12.2 m -119.09 -10.13 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.476 1.11 . . . . 1.98 109.253 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -171.41 -172.88 37.94 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.501 1.125 . . . . 2.4199999999999999 111.026 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.503 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.5 m-20 -90.11 -166.32 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.504 0.767 . . . . 6.2699999999999996 109.279 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -86.56 170.47 42.38 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.5 1.125 . . . . 1.6399999999999999 111.021 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.631 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 0.0 OUTLIER -92.6 40.99 1.06 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.517 0.775 . . . . 2.4199999999999999 111.012 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.637 HG23 ' O ' ' A' ' 18' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.496 0 O-C-N 124.461 1.101 . . . . 2.75 109.324 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.049 0 N-CA-C 110.998 -0.841 . . . . 1.1499999999999999 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.631 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -124.52 119.16 28.32 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.541 0.789 . . . . 1.26 109.56 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 35' ' ' VAL . . . -45.2 108.79 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.491 1.119 . . . . 1.01 109.316 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -77.51 -31.2 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.489 1.118 . . . . 4.5700000000000003 110.314 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.874 ' CZ ' HG11 ' A' ' 36' ' ' VAL . 15.7 p90 -173.93 175.69 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.503 1.127 . . . . 1.1299999999999999 110.973 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.716 HD21 HD13 ' A' ' 14' ' ' LEU . 51.7 mt -106.41 140.2 39.7 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.466 1.104 . . . . 1.1000000000000001 109.294 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.992 ' HB3' ' CG ' ' A' ' 34' ' ' LYS . . . -107.78 142.79 37.27 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.538 1.149 . . . . 0.54000000000000004 109.342 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -87.63 139.92 30.05 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 3.7999999999999998 110.279 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 2.75 108.3 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 110.29 -0.263 . . . . 3.9900000000000002 110.29 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 142.65 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.517 1.798 . . . . 0.55000000000000004 111.03 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.32 158.48 56.69 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.499 1.125 . . . . 0.59999999999999998 109.3 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 171.36 18.47 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.472 1.775 . . . . 0.71999999999999997 110.969 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -85.41 9.13 16.49 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.491 1.12 . . . . 2.2200000000000002 109.982 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.8 p -104.74 23.19 13.81 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.509 1.131 . . . . 1.01 108.298 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 24' ' ' ASP . 84.7 t -146.03 116.02 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.461 1.1 . . . . 0.60999999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.435 ' N ' ' O ' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -81.24 161.81 23.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 0.98999999999999999 110.44 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.576 HD13 HG23 ' A' ' 35' ' ' VAL . 16.1 tp -118.63 106.08 12.25 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.481 1.113 . . . . 0.60999999999999999 109.292 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.725 ' HD2' HG21 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -87.24 61.72 6.85 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.475 1.109 . . . . 1.6299999999999999 110.98 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.655 ' CD ' ' HB3' ' A' ' 67' ' ' ALA . 5.2 tt0 -78.24 96.84 5.34 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.572 1.17 . . . . 1.3799999999999999 110.327 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.34 -163.0 0.93 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 2.3199999999999998 109.996 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.69 ' HB2' HG21 ' A' ' 61' ' ' ILE . 66.1 p-90 -99.14 -49.79 4.37 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.479 1.112 . . . . 2.8100000000000001 108.045 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.577 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.03 -21.11 59.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 6.8300000000000001 110.284 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' CB ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -166.87 175.51 7.68 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.577 1.173 . . . . 5.5599999999999996 110.976 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 55' ' ' THR . 6.0 m -141.58 138.5 32.69 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 2.6800000000000002 109.968 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -137.66 -179.97 6.07 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.57 1.169 . . . . 2.3300000000000001 110.284 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -134.03 129.95 36.83 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.68999999999999995 109.33 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.634 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -95.12 136.25 35.67 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.555 1.16 . . . . 4.6299999999999999 109.301 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.475 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.0 t-20 -96.49 87.22 4.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.093 . . . . 0.45000000000000001 109.301 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.44 13.04 53.58 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.526 1.141 . . . . 0.56999999999999995 110.985 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.2 -155.64 0.33 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.328 -0.99 . . . . 1.6000000000000001 108.328 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.59 20.98 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.117 . . . . 1.1399999999999999 109.313 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.408 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -155.95 152.26 27.99 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 2.96 110.29 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.1 m -65.8 125.64 25.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 0.71999999999999997 110.353 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.24 159.52 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.424 1.077 . . . . 0.52000000000000002 109.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.556 HG22 ' HB2' ' A' ' 73' ' ' CYS . 67.1 m -114.58 143.71 44.56 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 0.65000000000000002 110.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.442 HG23 HD22 ' A' ' 70' ' ' LEU . 3.4 m -141.09 177.84 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 0.68000000000000005 109.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.617 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -154.96 105.53 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 1.9099999999999999 109.291 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.727 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -53.7 116.01 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 0.67000000000000004 109.3 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.883 HG22 ' HG2' ' A' ' 42' ' ' GLU . 23.2 t -99.39 120.36 48.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.461 1.101 . . . . 0.51000000000000001 109.292 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.434 ' OH ' ' N ' ' A' ' 58' ' ' ASP . 96.4 m-85 -83.94 167.92 16.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 1.0900000000000001 110.939 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.501 ' CG ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -58.47 -21.5 51.76 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.472 1.108 . . . . 3.98 110.286 179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -79.82 3.56 19.24 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.533 1.146 . . . . 2.29 109.313 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 75.22 3.06 4.02 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.485 1.116 . . . . 4.2199999999999998 109.281 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.4 p -78.73 144.94 34.78 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.492 1.12 . . . . 0.87 110.404 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.883 ' HG2' HG22 ' A' ' 36' ' ' VAL . 0.4 OUTLIER -121.36 142.38 50.04 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.497 1.123 . . . . 2.48 110.299 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.704 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -60.88 -106.65 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.484 1.115 . . . . 1.8300000000000001 110.961 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 43' ' ' GLY . 47.2 mt -153.02 140.15 19.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 0.773 . . . . 1.28 109.304 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.8 m -42.8 101.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 1.106 . . . . 1.8600000000000001 108.298 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 2.6 m-85 -108.98 111.91 23.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.46 1.1 . . . . 2.3999999999999999 111.031 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.83 128.84 35.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.52 1.138 . . . . 0.55000000000000004 109.332 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.663 HG22 ' HB ' ' A' ' 54' ' ' THR . 69.6 t -128.79 140.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.465 1.103 . . . . 0.33000000000000002 109.356 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.686 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.51 171.77 11.5 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.515 1.134 . . . . 0.46999999999999997 109.292 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.686 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.5 Cg_endo -74.97 102.52 1.6 Allowed 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.475 1.776 . . . . 0.66000000000000003 111.044 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 105.13 36.55 2.89 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.507 1.129 . . . . 0.66000000000000003 110.989 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.748 ' C ' HD13 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -144.94 158.27 43.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.545 0.791 . . . . 2.2400000000000002 110.291 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.748 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -126.68 141.75 45.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.444 1.09 . . . . 0.95999999999999996 109.326 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.663 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -146.45 141.31 27.0 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.476 1.11 . . . . 0.76000000000000001 110.376 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.58 141.5 54.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 1.25 110.408 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 15.3 m -129.59 1.21 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 2.3700000000000001 109.311 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 21' ' ' SER . . . 164.37 -173.48 40.34 Favored Glycine 0 CA--C 1.529 0.962 0 O-C-N 124.55 1.156 . . . . 2.2999999999999998 111.048 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.434 ' N ' ' OH ' ' A' ' 37' ' ' TYR . 7.9 m-20 -92.61 -173.58 3.4 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 0.777 . . . . 5.8700000000000001 109.305 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -83.68 -176.78 51.44 Favored Glycine 0 CA--C 1.53 0.98 0 O-C-N 124.551 1.157 . . . . 1.22 111.03 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -101.13 27.95 5.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.501 0.765 . . . . 2.6899999999999999 111.016 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.69 HG21 ' HB2' ' A' ' 18' ' ' TRP . 1.3 pp . . . . . 0 C--N 1.325 -0.478 0 O-C-N 124.512 1.132 . . . . 2.8100000000000001 109.317 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 N-CA-C 111.004 -0.838 . . . . 1.28 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.408 ' O ' ' C ' ' A' ' 67' ' ' ALA . 2.3 m-70 -107.93 107.0 17.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 0.764 . . . . 2.4500000000000002 109.589 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.655 ' HB3' ' CD ' ' A' ' 16' ' ' GLN . . . -39.66 113.18 0.31 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.493 1.12 . . . . 0.60999999999999999 109.28 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -78.14 -38.34 43.95 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.119 . . . . 6.0899999999999999 110.317 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.502 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 18.1 p90 179.53 -166.12 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.492 1.12 . . . . 1.1299999999999999 111.02 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 35' ' ' VAL . 70.9 mt -115.24 138.24 51.16 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.527 1.142 . . . . 1.26 109.32 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.617 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.42 139.4 50.48 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.499 1.124 . . . . 0.60999999999999999 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.8 147.3 51.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.536 1.147 . . . . 3.1699999999999999 110.344 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.556 ' HB2' HG22 ' A' ' 32' ' ' THR . 40.7 t . . . . . 0 C--N 1.325 -0.494 0 O-C-N 124.461 1.101 . . . . 2.6600000000000001 108.307 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.418 ' CG ' ' HB2' ' A' ' 72' ' ' ARG . 43.1 tp10 . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 110.282 -0.266 . . . . 3.4199999999999999 110.282 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 139.6 24.46 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.524 1.802 . . . . 0.67000000000000004 110.998 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.622 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 168.45 0.95 Allowed Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 0.60999999999999999 109.313 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.622 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.3 Cg_endo -75.0 170.0 21.39 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.518 1.799 . . . . 0.80000000000000004 111.004 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.54 13.31 12.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 2.2799999999999998 110.024 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.2 p -112.65 21.46 15.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.492 1.12 . . . . 0.95999999999999996 108.294 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.592 HG22 ' HA ' ' A' ' 25' ' ' ASN . 3.1 t -139.5 123.04 18.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 0.67000000000000004 109.28 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 154.31 19.21 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.436 1.085 . . . . 1.1000000000000001 110.409 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.966 HD13 HD21 ' A' ' 70' ' ' LEU . 6.1 tp -108.07 111.96 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 0.54000000000000004 109.319 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -93.23 58.06 2.8 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 1.51 110.97 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.55 ' HB2' HD11 ' A' ' 14' ' ' LEU . 4.8 tt0 -74.48 98.43 3.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.52 1.138 . . . . 1.51 110.311 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.493 ' HG ' ' H ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -92.6 -160.84 0.78 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.483 1.115 . . . . 1.22 109.998 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.825 ' O ' HD11 ' A' ' 61' ' ' ILE . 29.8 p-90 -99.5 -46.48 5.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 2.8900000000000001 107.97 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -71.67 -34.24 69.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 5.7400000000000002 110.307 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.567 ' CD2' HG21 ' A' ' 55' ' ' THR . 0.1 OUTLIER -167.45 157.29 10.62 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.138 . . . . 6.0700000000000003 111.005 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 2.8 t -105.94 134.96 48.23 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 1.9199999999999999 110.01 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.566 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 9.5 mt-30 -125.74 172.15 10.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 2.0800000000000001 110.259 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.795 ' HB2' HG11 ' A' ' 56' ' ' VAL . . . -134.76 129.23 34.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.523 1.14 . . . . 0.5 109.301 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 25' ' ' ASN . 2.8 t0 -102.65 133.46 47.62 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 2.2000000000000002 109.288 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.592 ' HA ' HG22 ' A' ' 12' ' ' VAL . 60.8 t-20 -93.67 93.77 8.21 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.489 1.118 . . . . 0.5 109.262 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.51 9.6 70.23 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.519 1.137 . . . . 0.60999999999999999 110.993 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.55 -167.71 1.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 1.6399999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.422 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -125.2 25.44 7.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.576 1.173 . . . . 1.1499999999999999 109.3 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.411 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 10.3 mt-10 -158.09 144.82 17.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.502 1.126 . . . . 2.2999999999999998 110.28 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.0 m -61.78 128.89 38.41 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.454 1.096 . . . . 0.73999999999999999 110.359 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.21 162.25 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.497 1.123 . . . . 0.52000000000000002 109.282 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.495 HG22 ' HB2' ' A' ' 73' ' ' CYS . 49.0 m -111.94 143.61 42.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.469 1.106 . . . . 0.54000000000000004 110.405 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.438 HG11 HG11 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -140.71 177.94 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.453 1.096 . . . . 0.54000000000000004 109.318 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -160.67 110.48 1.73 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.55 1.156 . . . . 2.02 109.329 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.804 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -61.88 114.35 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.46 1.1 . . . . 0.71999999999999997 109.273 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.952 HG22 ' HG2' ' A' ' 42' ' ' GLU . 84.7 t -96.05 117.62 40.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.502 1.126 . . . . 0.5 109.286 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.498 ' OH ' ' N ' ' A' ' 58' ' ' ASP . 25.2 m-85 -75.45 173.47 10.92 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 1.72 111.048 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 1.8 mm-40 -81.16 -12.06 59.3 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.462 1.102 . . . . 3.6400000000000001 110.255 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.457 ' CG ' ' OG1' ' A' ' 41' ' ' THR . 5.2 p-10 -93.73 34.0 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.102 . . . . 2.6499999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' O ' HG23 ' A' ' 41' ' ' THR . 1.7 m-20 46.96 67.38 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.133 . . . . 4.2599999999999998 109.306 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.457 ' OG1' ' CG ' ' A' ' 39' ' ' ASP . 1.0 OUTLIER -152.29 152.16 31.81 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.463 1.102 . . . . 0.92000000000000004 110.357 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.9 mt-10 -130.9 139.58 50.11 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 2.0499999999999998 110.313 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -58.95 -103.94 0.01 OUTLIER Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.537 1.148 . . . . 1.72 110.996 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.685 HD23 ' O ' ' A' ' 43' ' ' GLY . 45.1 mt -153.6 139.66 18.3 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 1.3200000000000001 109.319 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.7 m -51.53 103.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.496 1.123 . . . . 1.6299999999999999 108.328 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 33.2 m-85 -112.05 122.87 48.96 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 1.72 111.017 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.67 123.77 38.3 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.493 1.121 . . . . 0.5 109.301 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 25' ' ' ASN . 68.2 t -122.36 138.34 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.499 1.124 . . . . 0.35999999999999999 109.318 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.726 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.93 173.51 7.61 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.52 1.137 . . . . 0.48999999999999999 109.35 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.726 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 97.74 1.1 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.487 1.783 . . . . 0.65000000000000002 111.0 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 109.9 35.27 2.22 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.507 1.13 . . . . 0.80000000000000004 110.967 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.723 ' C ' HD13 ' A' ' 53' ' ' ILE . 4.1 mt-30 -140.05 159.48 42.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.511 0.771 . . . . 3.54 110.289 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.723 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -128.82 140.27 49.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 O-C-N 124.496 1.122 . . . . 0.98999999999999999 109.284 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.544 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.6 OUTLIER -148.05 147.76 29.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.556 1.16 . . . . 0.95999999999999996 110.418 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.567 HG21 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -60.94 146.15 47.83 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.508 1.13 . . . . 1.6299999999999999 110.427 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.795 HG11 ' HB2' ' A' ' 23' ' ' ALA . 29.5 m -132.64 -0.54 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.479 1.112 . . . . 2.6600000000000001 109.332 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 162.52 -169.46 37.8 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.519 1.137 . . . . 2.25 111.014 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.51 ' O ' ' CB ' ' A' ' 21' ' ' SER . 4.4 m-20 -89.67 -164.63 1.18 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.513 0.773 . . . . 5.6699999999999999 109.309 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -86.53 -169.06 45.54 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.514 1.134 . . . . 1.1399999999999999 111.007 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.649 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 18.5 p90 -90.86 -7.09 53.23 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.537 0.786 . . . . 1.9199999999999999 110.975 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.825 HD11 ' O ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.552 1.158 . . . . 2.9500000000000002 109.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.016 0 N-CA-C 111.011 -0.836 . . . . 0.83999999999999997 111.011 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.649 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -118.82 131.29 56.09 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.535 0.785 . . . . 1.22 109.644 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.452 ' HB3' ' NE2' ' A' ' 16' ' ' GLN . . . -46.33 122.59 4.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.67000000000000004 109.309 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -77.9 -47.38 18.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.575 1.172 . . . . 5.5 110.287 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CE2' ' HD2' ' A' ' 68' ' ' ARG . 6.2 p90 -174.85 -177.5 1.13 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.496 1.123 . . . . 1.0600000000000001 110.988 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.966 HD21 HD13 ' A' ' 14' ' ' LEU . 7.9 mt -105.69 135.05 47.8 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.551 1.157 . . . . 1.51 109.28 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 6' ' ' GLU . . . -123.19 148.52 45.71 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.507 1.129 . . . . 0.54000000000000004 109.295 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB2' ' CG ' ' A' ' 6' ' ' GLU . 3.6 mtt180 -81.3 154.49 26.51 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.511 1.132 . . . . 4.3300000000000001 110.301 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 32' ' ' THR . 38.1 t . . . . . 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.124 . . . . 2.6299999999999999 108.324 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 110.311 -0.255 . . . . 3.0699999999999998 110.311 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 148.88 35.75 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.552 1.817 . . . . 0.76000000000000001 110.978 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -76.07 150.35 83.21 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.109 . . . . 1.28 109.325 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.425 ' HD3' ' NE ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 -176.1 2.71 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.435 1.755 . . . . 1.5800000000000001 110.985 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.52 6.34 20.81 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.456 1.098 . . . . 1.8300000000000001 109.988 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 26' ' ' GLY . 2.0 p -96.42 20.09 11.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.533 1.146 . . . . 1.1399999999999999 108.327 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.576 HG21 ' NH1' ' A' ' 72' ' ' ARG . 70.0 t -149.47 121.83 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.517 1.135 . . . . 0.63 109.257 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.47 136.75 36.54 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.531 1.145 . . . . 1.0700000000000001 110.385 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.483 ' HA ' HD11 ' A' ' 70' ' ' LEU . 32.5 tp -89.98 105.53 17.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.545 1.153 . . . . 0.62 109.311 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.545 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -96.44 65.44 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.446 1.091 . . . . 1.27 110.958 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.674 ' OE1' ' HB3' ' A' ' 67' ' ' ALA . 17.4 tt0 -77.2 120.63 22.53 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 1.55 110.278 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.592 ' O ' ' CD2' ' A' ' 60' ' ' TYR . 6.4 p -87.77 -144.22 0.13 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.476 1.11 . . . . 1.3700000000000001 109.976 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.983 ' O ' HD12 ' A' ' 61' ' ' ILE . 32.4 p-90 -101.74 -54.76 2.66 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 108.012 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.637 ' HB3' ' CE3' ' A' ' 18' ' ' TRP . 2.8 ptt180 -107.67 14.75 25.32 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.489 1.118 . . . . 5.5099999999999998 110.299 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.616 ' CD1' ' HA2' ' A' ' 57' ' ' GLY . 0.2 OUTLIER -168.24 176.26 6.05 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.502 1.126 . . . . 5.4800000000000004 110.99 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.488 ' OG ' ' N ' ' A' ' 58' ' ' ASP . 5.1 p -143.61 159.73 41.93 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.496 1.122 . . . . 2.3300000000000001 110.022 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.545 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 3.2 mt-30 -141.26 135.92 31.12 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.49 1.118 . . . . 2.04 110.333 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.411 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -100.51 117.87 35.55 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.47 1.106 . . . . 0.60999999999999999 109.258 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 24' ' ' ASP . 2.2 t0 -98.22 113.7 25.72 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.502 1.126 . . . . 2.7200000000000002 109.272 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.608 ' HB2' HG12 ' A' ' 48' ' ' VAL . 58.5 t-20 -78.16 102.19 7.42 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.524 1.14 . . . . 0.63 109.249 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.7 3.52 81.38 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.452 1.095 . . . . 0.68000000000000005 110.985 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.13 -161.76 0.58 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.342 -0.985 . . . . 1.45 108.342 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.464 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -130.5 21.22 5.15 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 1.3400000000000001 109.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.428 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -153.31 147.55 25.75 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.469 1.106 . . . . 3.4300000000000002 110.357 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.8 m -59.47 127.87 34.21 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.492 1.12 . . . . 0.76000000000000001 110.392 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.518 HG21 HH12 ' A' ' 72' ' ' ARG . 15.9 m -141.87 154.06 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.513 1.133 . . . . 0.76000000000000001 109.329 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.688 HG21 ' SG ' ' A' ' 45' ' ' CYS . 1.8 m -101.73 141.19 34.97 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.524 1.14 . . . . 0.84999999999999998 110.425 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.411 HG21 ' CB ' ' A' ' 23' ' ' ALA . 1.8 m -129.93 170.69 18.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.445 1.091 . . . . 0.87 109.345 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.836 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 2.0 ptmt -160.64 89.46 0.82 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.504 1.128 . . . . 2.3700000000000001 109.289 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.91 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.8 OUTLIER -40.03 139.01 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.68999999999999995 109.35 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.906 HG22 ' HG2' ' A' ' 42' ' ' GLU . 75.0 t -118.03 117.29 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.531 1.144 . . . . 0.90000000000000002 109.282 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.417 ' OH ' ' OD1' ' A' ' 58' ' ' ASP . 78.4 m-85 -73.64 166.55 23.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 0.98999999999999999 110.984 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -5.59 33.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.505 1.128 . . . . 3.27 110.297 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.4 9.4 31.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.424 1.077 . . . . 2.6200000000000001 109.337 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.459 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 78.52 -1.25 2.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.479 1.112 . . . . 3.9300000000000002 109.293 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.2 p -83.2 167.63 17.54 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.539 1.149 . . . . 1.22 110.395 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.906 ' HG2' HG22 ' A' ' 36' ' ' VAL . 16.3 mt-10 -134.54 170.28 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.475 1.109 . . . . 2.1699999999999999 110.306 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.564 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -83.83 -115.57 0.63 Allowed Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.554 1.159 . . . . 2.0 111.017 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 43' ' ' GLY . 36.1 mt -148.44 147.58 29.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.501 0.766 . . . . 1.6100000000000001 109.299 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.688 ' SG ' HG21 ' A' ' 32' ' ' THR . 0.4 OUTLIER -47.2 120.33 3.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 1.112 . . . . 2.1299999999999999 108.285 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 1.116 ' CD2' HG12 ' A' ' 56' ' ' VAL . 6.1 m-85 -137.22 108.05 6.65 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.141 . . . . 1.8999999999999999 110.973 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.27 134.61 34.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.56999999999999995 109.255 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.809 HG22 ' HB ' ' A' ' 54' ' ' THR . 49.7 t -133.11 141.74 43.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.448 1.092 . . . . 0.33000000000000002 109.302 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.78 167.08 35.13 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.474 1.109 . . . . 0.53000000000000003 109.291 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -75.09 117.98 5.08 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.514 1.797 . . . . 0.87 110.954 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.6 28.76 18.25 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.492 1.12 . . . . 1.02 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.937 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -132.16 167.18 20.21 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.483 0.755 . . . . 2.4500000000000002 110.297 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.937 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -135.75 125.11 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 1.1200000000000001 109.284 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.809 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -125.78 137.23 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.124 . . . . 1.0 110.381 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 21' ' ' SER . 6.1 m -82.03 127.65 33.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.487 1.117 . . . . 1.9099999999999999 110.431 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 1.116 HG12 ' CD2' ' A' ' 46' ' ' TYR . 3.6 m -95.83 -51.97 10.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.522 1.138 . . . . 3.21 109.36 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.616 ' HA2' ' CD1' ' A' ' 20' ' ' TYR . . . 119.63 89.6 1.2 Allowed Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.517 1.136 . . . . 2.73 110.993 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.843 ' CG ' HG11 ' A' ' 35' ' ' VAL . 7.7 m-20 -170.24 126.32 0.79 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.508 0.77 . . . . 6.1799999999999997 109.354 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -131.76 162.27 23.8 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.494 1.121 . . . . 1.28 110.993 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.754 ' CE1' HG22 ' A' ' 61' ' ' ILE . 42.6 p90 -95.54 -6.94 39.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 0.762 . . . . 2.1299999999999999 111.023 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.454 0 O-C-N 124.484 1.115 . . . . 2.3999999999999999 109.269 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.021 0 N-CA-C 110.978 -0.849 . . . . 0.91000000000000003 110.978 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.579 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -116.45 165.08 13.63 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.507 0.769 . . . . 1.1599999999999999 109.575 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.674 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -83.01 121.6 27.22 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.561 1.163 . . . . 0.70999999999999996 109.321 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -75.74 -46.3 31.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.419 1.075 . . . . 4.5099999999999998 110.273 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 17.9 p90 178.92 161.74 0.72 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.494 1.121 . . . . 1.6100000000000001 111.002 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.91 ' CD2' HG23 ' A' ' 35' ' ' VAL . 17.4 mt -81.57 139.96 34.76 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.5 1.125 . . . . 1.3999999999999999 109.311 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.836 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -117.22 132.06 56.72 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.482 1.114 . . . . 0.62 109.319 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.576 ' NH1' HG21 ' A' ' 12' ' ' VAL . 3.9 mmt180 -63.5 144.87 56.62 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 5.5899999999999999 110.295 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.9 t . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.547 1.155 . . . . 2.73 108.276 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 110.278 -0.267 . . . . 4.3399999999999999 110.278 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 134.73 18.24 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.524 1.802 . . . . 0.69999999999999996 111.024 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -58.37 166.75 2.04 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.496 1.122 . . . . 0.66000000000000003 109.322 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.632 ' HB3' HH21 ' A' ' 72' ' ' ARG . 18.3 Cg_endo -75.05 176.1 10.37 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.509 1.794 . . . . 0.77000000000000002 111.027 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 t -92.2 13.99 17.52 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.479 1.112 . . . . 2.5099999999999998 110.0 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 7.4 p -99.94 -18.23 17.18 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.5 1.125 . . . . 1.1599999999999999 108.29 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.834 HG12 HD12 ' A' ' 70' ' ' LEU . 1.4 t -97.77 117.9 43.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.548 1.155 . . . . 1.01 109.303 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.98 139.55 30.48 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.461 1.101 . . . . 1.25 110.39 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.87 HD13 HD21 ' A' ' 70' ' ' LEU . 10.3 tp -96.86 114.12 25.72 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 0.77000000000000002 109.283 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.8 OUTLIER -106.97 70.37 0.8 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 1.23 111.002 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HA ' ' CB ' ' A' ' 21' ' ' SER . 2.8 tt0 -78.6 127.8 32.62 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 1.3999999999999999 110.317 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.596 ' O ' ' CE2' ' A' ' 60' ' ' TYR . 1.7 p -110.8 -151.63 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.52 1.138 . . . . 1.1100000000000001 109.985 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.671 ' HB2' HG21 ' A' ' 61' ' ' ILE . 28.1 p-90 -97.5 -47.49 5.64 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.524 1.14 . . . . 2.1899999999999999 108.026 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -37.55 55.29 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.128 . . . . 6.0800000000000001 110.278 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.547 ' C ' ' O ' ' A' ' 58' ' ' ASP . 6.4 p90 -166.22 -177.06 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.561 1.163 . . . . 7.2000000000000002 110.981 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 55' ' ' THR . 27.4 t -117.97 164.07 15.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 2.73 109.968 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 1.4 mt-30 -138.41 130.34 28.23 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 1.95 110.286 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -95.1 119.37 33.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 0.56999999999999995 109.301 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.626 ' HA ' HG23 ' A' ' 53' ' ' ILE . 2.1 t0 -97.68 115.59 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 2.25 109.26 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' A' ' 49' ' ' ALA . 38.3 t-20 -77.59 84.56 3.95 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.474 1.109 . . . . 0.66000000000000003 109.269 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.78 15.7 59.96 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.502 1.127 . . . . 0.67000000000000004 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.413 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -93.78 11.35 29.52 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.313 -0.995 . . . . 2.7599999999999998 108.313 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.5 32.45 0.09 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 2.02 109.321 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -158.01 133.72 9.07 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.555 1.159 . . . . 2.5899999999999999 110.321 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.42 HG23 ' HA ' ' A' ' 49' ' ' ALA . 3.0 m -50.23 119.33 3.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 0.89000000000000001 110.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 29' ' ' GLU . 27.4 m -145.82 163.68 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.456 1.098 . . . . 0.65000000000000002 109.304 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 47' ' ' ALA . 23.3 m -117.66 146.63 43.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.535 1.147 . . . . 0.66000000000000003 110.409 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.548 HG11 HG11 ' A' ' 12' ' ' VAL . 1.1 m -142.31 176.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.512 1.133 . . . . 0.57999999999999996 109.308 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.828 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 0.7 OUTLIER -160.19 103.56 1.45 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 2.4700000000000002 109.338 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 1.043 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -60.44 137.03 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.56000000000000005 109.341 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.885 HG22 ' HG2' ' A' ' 42' ' ' GLU . 13.0 t -116.64 124.23 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.85999999999999999 109.275 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.664 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 54.6 m-85 -76.26 166.71 23.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.466 1.104 . . . . 1.03 111.03 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 1.2 tt0 -61.42 -14.38 27.79 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 3.6200000000000001 110.29 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -84.87 7.93 19.23 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 1.97 109.265 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 t0 71.92 6.21 5.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.09 . . . . 3.9300000000000002 109.278 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.597 HG23 ' HB2' ' A' ' 39' ' ' ASP . 42.5 p -87.35 151.3 23.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 0.98999999999999999 110.409 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.885 ' HG2' HG22 ' A' ' 36' ' ' VAL . 4.6 mt-10 -118.52 141.42 48.58 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.512 1.132 . . . . 1.9399999999999999 110.338 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -65.89 -94.54 0.03 OUTLIER Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.475 1.109 . . . . 1.77 111.0 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 43' ' ' GLY . 50.8 mt -153.84 139.86 18.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.554 0.797 . . . . 1.3100000000000001 109.333 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 113.91 8.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.505 1.128 . . . . 1.6299999999999999 108.324 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.456 ' HD2' HG12 ' A' ' 56' ' ' VAL . 3.3 m-85 -124.03 138.47 54.44 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 1.138 . . . . 2.0600000000000001 111.019 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -96.09 115.6 27.68 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.506 1.129 . . . . 0.64000000000000001 109.318 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.968 HG22 ' HB ' ' A' ' 54' ' ' THR . 96.5 t -99.72 131.94 46.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 O-C-N 124.511 1.132 . . . . 0.51000000000000001 109.36 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -68.44 171.97 5.19 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 0.94999999999999996 109.334 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -74.99 111.54 3.35 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.5 1.789 . . . . 1.46 110.981 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.33 21.58 44.31 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.52 1.137 . . . . 0.68000000000000005 111.016 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.863 ' HG3' HG13 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -123.03 155.27 37.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.514 0.773 . . . . 2.8799999999999999 110.268 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.626 HG23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -122.36 129.49 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.529 1.143 . . . . 1.1799999999999999 109.328 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.968 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -126.92 138.6 53.32 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.459 1.099 . . . . 0.94999999999999996 110.425 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.534 ' CG2' ' CD1' ' A' ' 20' ' ' TYR . 2.0 m -78.41 139.48 38.75 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 1.3200000000000001 110.347 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 35' ' ' VAL . 3.6 m -113.51 -50.49 5.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.548 1.155 . . . . 2.2200000000000002 109.291 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.463 ' O ' HG11 ' A' ' 35' ' ' VAL . . . 132.53 123.14 2.41 Favored Glycine 0 CA--C 1.531 1.037 0 O-C-N 124.471 1.107 . . . . 2.8999999999999999 110.962 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.664 ' OD1' ' CE2' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 165.78 127.13 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.536 0.786 . . . . 7.0300000000000002 109.278 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -147.52 123.42 1.73 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.51 1.131 . . . . 1.3999999999999999 110.983 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.596 ' CE2' ' O ' ' A' ' 17' ' ' SER . 15.2 p90 -70.39 1.87 4.52 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.48 0.753 . . . . 2.6200000000000001 111.008 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.671 HG21 ' HB2' ' A' ' 18' ' ' TRP . 9.6 tt . . . . . 0 C--N 1.325 -0.477 0 O-C-N 124.461 1.101 . . . . 4.6399999999999997 109.316 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.972 0 N-CA-C 111.002 -0.839 . . . . 1.0900000000000001 111.002 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.574 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -120.53 135.73 54.99 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.482 0.754 . . . . 1.45 109.611 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.637 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . . . -36.73 134.59 0.48 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 0.89000000000000001 109.329 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.563 ' CD ' ' HA ' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -91.49 -47.24 7.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.473 1.108 . . . . 4.7800000000000002 110.269 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.582 ' CD1' ' HB ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -178.11 173.95 1.42 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 2.25 110.993 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 1.043 ' CD2' HG23 ' A' ' 35' ' ' VAL . 4.5 mt -96.85 144.78 26.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.486 1.117 . . . . 1.5 109.249 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.828 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -125.94 129.58 49.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.494 1.121 . . . . 0.47999999999999998 109.289 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.632 HH21 ' HB3' ' A' ' 9' ' ' PRO . 4.5 ptp180 -85.57 141.74 29.63 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.53 1.144 . . . . 3.79 110.316 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 2.1000000000000001 108.305 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 1.8 tt0 . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 110.238 -0.282 . . . . 3.0 110.238 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 138.37 22.88 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.512 1.796 . . . . 0.71999999999999997 110.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.67 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.68 170.09 0.31 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 0.67000000000000004 109.309 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.67 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.03 167.46 26.98 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.474 1.776 . . . . 0.94999999999999996 110.977 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 45.5 p -85.06 7.67 20.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.517 1.136 . . . . 2.6000000000000001 110.008 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 6.1 p -114.76 29.79 7.78 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 1.01 108.255 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 33' ' ' VAL . 89.1 t -143.25 109.66 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.536 1.148 . . . . 0.63 109.299 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.43 153.79 29.43 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 0.91000000000000003 110.436 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.525 HD13 HG23 ' A' ' 35' ' ' VAL . 15.1 tp -105.23 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.443 1.09 . . . . 0.54000000000000004 109.327 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -88.64 57.27 4.11 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.541 1.15 . . . . 1.71 110.946 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.438 ' HA ' ' HA ' ' A' ' 21' ' ' SER . 3.8 tt0 -76.26 100.71 5.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 1.3999999999999999 110.3 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.627 ' O ' ' CE1' ' A' ' 60' ' ' TYR . 1.4 p -77.79 -150.41 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.445 1.091 . . . . 1.0900000000000001 109.984 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 1.101 ' CA ' HD11 ' A' ' 61' ' ' ILE . 34.6 p-90 -98.45 -65.18 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.045 -1.094 . . . . 2.2000000000000002 108.045 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.594 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -93.1 16.68 12.33 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.486 1.116 . . . . 5.8600000000000003 110.329 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 1.082 ' CE2' HG21 ' A' ' 55' ' ' THR . 0.0 OUTLIER -168.71 161.62 11.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 5.0099999999999998 110.984 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.486 ' OG ' ' C ' ' A' ' 57' ' ' GLY . 65.1 p -143.28 135.6 27.16 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 110.027 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.609 ' OE1' HG23 ' A' ' 55' ' ' THR . 0.0 OUTLIER -135.25 177.87 7.47 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.507 1.129 . . . . 2.4500000000000002 110.314 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.23 133.72 39.28 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.524 1.14 . . . . 0.65000000000000002 109.266 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG1' ' A' ' 53' ' ' ILE . 39.8 t0 -103.29 130.44 50.56 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 2.29 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.638 ' HB2' HG12 ' A' ' 48' ' ' VAL . 23.7 t-20 -84.4 96.87 9.21 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.444 1.09 . . . . 0.62 109.285 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -86.47 2.01 87.36 Favored Glycine 0 CA--C 1.529 0.968 0 O-C-N 124.53 1.144 . . . . 0.64000000000000001 111.023 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.465 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -88.94 -157.76 0.46 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.272 -1.01 . . . . 1.6200000000000001 108.272 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.414 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -131.1 16.29 5.1 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 1.1499999999999999 109.315 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -144.14 152.15 40.53 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.562 1.164 . . . . 2.9900000000000002 110.285 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 48' ' ' VAL . 90.7 m -71.48 130.8 42.19 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.528 1.143 . . . . 1.0 110.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.8 m -141.46 164.0 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.467 1.105 . . . . 0.59999999999999998 109.294 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 ' SG ' ' A' ' 73' ' ' CYS . 74.9 m -113.25 141.44 46.99 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.67000000000000004 110.415 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 12' ' ' VAL . 1.2 m -137.74 174.17 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.468 1.105 . . . . 0.56999999999999995 109.282 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.645 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 5.3 pttt -155.33 105.21 2.47 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 1.9399999999999999 109.316 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.595 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.27 115.65 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.516 1.135 . . . . 0.78000000000000003 109.248 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.876 HG22 ' HG2' ' A' ' 42' ' ' GLU . 99.2 t -98.85 119.3 46.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.56000000000000005 109.277 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 67' ' ' ALA . 68.7 m-85 -78.61 170.05 17.26 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 1.22 110.998 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG3' ' CG ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -68.05 -12.45 60.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.527 1.142 . . . . 4.46 110.297 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.3 16.62 7.13 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.504 1.128 . . . . 1.8 109.285 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.2 t0 65.22 10.68 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 3.9199999999999999 109.306 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.1 OUTLIER -83.99 155.07 22.95 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.547 1.154 . . . . 1.23 110.381 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.876 ' HG2' HG22 ' A' ' 36' ' ' VAL . 13.0 mt-10 -133.33 127.07 32.75 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.485 1.116 . . . . 2.3300000000000001 110.273 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.721 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -52.29 -105.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.496 1.123 . . . . 1.79 110.989 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.721 HD23 ' O ' ' A' ' 43' ' ' GLY . 49.9 mt -153.23 138.06 17.09 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.442 0.731 . . . . 1.4199999999999999 109.302 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.429 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -55.05 112.08 0.98 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.529 1.143 . . . . 1.3899999999999999 108.282 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.598 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 35.2 m-85 -121.74 123.71 42.48 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.525 1.141 . . . . 1.52 110.983 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.45 120.18 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.53 1.144 . . . . 0.46000000000000002 109.3 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.638 HG12 ' HB2' ' A' ' 25' ' ' ASN . 53.4 t -115.9 142.7 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.495 1.122 . . . . 0.40000000000000002 109.331 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.654 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -86.31 169.47 15.18 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.554 1.159 . . . . 0.51000000000000001 109.352 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.654 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.0 104.84 1.97 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.517 1.798 . . . . 0.75 111.02 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.86 34.78 2.93 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.494 1.121 . . . . 0.76000000000000001 111.022 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -152.33 158.08 42.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.461 0.741 . . . . 2.3399999999999999 110.276 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' ' HA ' ' A' ' 24' ' ' ASP . 8.0 mt -126.21 153.33 34.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.478 1.111 . . . . 2.02 109.294 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.536 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.5 OUTLIER -153.65 142.94 21.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.459 1.099 . . . . 0.85999999999999999 110.401 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 55' ' ' THR . . . . . 1.082 HG21 ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -62.84 142.89 58.04 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 1.26 110.391 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.52 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 4.4 m -122.92 -7.28 8.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 2.0499999999999998 109.29 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.486 ' C ' ' OG ' ' A' ' 21' ' ' SER . . . 159.48 -156.17 27.3 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.485 1.115 . . . . 2.3799999999999999 111.027 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.452 ' HA ' ' HA ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -91.65 179.0 5.76 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 0.773 . . . . 6.21 109.304 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.471 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -89.45 -145.43 12.25 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.542 1.151 . . . . 1.4299999999999999 110.959 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.627 ' CE1' ' O ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -98.46 -1.2 41.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.491 0.76 . . . . 2.7200000000000002 110.968 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 1.101 HD11 ' CA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.472 1.107 . . . . 4.4000000000000004 109.341 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.982 0 N-CA-C 111.01 -0.836 . . . . 0.90000000000000002 111.01 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.529 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.8 OUTLIER -121.27 123.49 42.33 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.522 0.778 . . . . 1.1200000000000001 109.56 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.498 ' HB1' HG22 ' A' ' 35' ' ' VAL . . . -43.06 117.76 1.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 0.56000000000000005 109.306 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -76.62 -40.9 47.9 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 4.4299999999999997 110.326 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 12.5 p90 -178.24 -170.21 0.22 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.541 1.15 . . . . 1.02 110.959 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.595 HD23 ' HA ' ' A' ' 35' ' ' VAL . 51.8 mt -114.64 134.5 55.02 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.516 1.135 . . . . 1.1599999999999999 109.329 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.645 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -113.92 130.0 56.55 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.478 1.111 . . . . 0.53000000000000003 109.297 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.444 HH21 ' HB3' ' A' ' 9' ' ' PRO . 3.3 ptp180 -86.49 138.69 31.54 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 4.6600000000000001 110.276 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.467 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 O-C-N 124.486 1.116 . . . . 2.4199999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.56 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 1.3 tt0 . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 110.267 -0.272 . . . . 3.73 110.267 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 142.93 28.56 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.538 1.81 . . . . 0.70999999999999996 111.031 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.884 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -74.43 179.81 1.2 Allowed Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.482 1.114 . . . . 0.75 109.296 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.884 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.4 Cg_endo -74.94 165.19 31.88 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.545 1.813 . . . . 0.94999999999999996 111.018 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.7 m -90.47 16.26 9.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.554 1.159 . . . . 2.3100000000000001 110.006 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.455 ' O ' ' N ' ' A' ' 26' ' ' GLY . 26.6 p -108.43 12.28 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.493 1.121 . . . . 0.90000000000000002 108.293 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 33' ' ' VAL . 75.4 t -128.07 117.57 46.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 0.68999999999999995 109.288 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.34 145.45 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.96999999999999997 110.386 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.572 HD13 HD21 ' A' ' 70' ' ' LEU . 43.9 tp -101.63 105.46 16.4 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 0.58999999999999997 109.326 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.547 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -98.08 65.91 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 1.3600000000000001 110.999 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.466 HE21 ' HB3' ' A' ' 16' ' ' GLN . 0.3 OUTLIER -79.5 118.27 21.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.449 1.093 . . . . 1.3300000000000001 110.312 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -100.84 -157.55 0.62 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.505 1.128 . . . . 1.22 110.007 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.876 ' HB2' HG23 ' A' ' 61' ' ' ILE . 62.9 p-90 -96.06 -45.35 6.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.522 1.139 . . . . 2.04 107.991 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 17.9 ptt180 -77.53 -37.02 51.78 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.45 1.094 . . . . 7.1500000000000004 110.31 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.633 ' CD2' ' HA2' ' A' ' 57' ' ' GLY . 0.3 OUTLIER -164.6 173.7 11.67 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 7.0199999999999996 111.01 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.51 ' O ' ' CG2' ' A' ' 55' ' ' THR . 54.4 p -116.75 158.12 24.38 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 2.1699999999999999 109.992 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.798 ' HG2' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -142.76 134.44 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.475 1.109 . . . . 3.04 110.315 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.463 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -98.01 128.68 44.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 0.44 109.282 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -106.22 120.4 41.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.547 1.155 . . . . 2.48 109.32 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.639 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.6 t-20 -77.81 89.98 4.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.549 1.155 . . . . 0.52000000000000002 109.286 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -83.98 8.16 67.8 Favored Glycine 0 CA--C 1.531 1.036 0 O-C-N 124.527 1.142 . . . . 0.76000000000000001 110.989 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.65 -156.36 0.24 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.314 -0.995 . . . . 1.8 108.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.35 18.84 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.51 1.131 . . . . 1.04 109.279 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.74 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.2 mt-10 -155.85 135.05 12.19 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.119 . . . . 1.98 110.241 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.5 m -41.67 124.83 2.62 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 0.78000000000000003 110.406 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.74 HG13 ' O ' ' A' ' 29' ' ' GLU . 17.5 m -139.35 154.8 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 0.93000000000000005 109.292 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.527 HG22 ' HB2' ' A' ' 73' ' ' CYS . 30.7 m -108.09 146.18 33.0 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 0.88 110.378 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -138.16 172.01 14.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.54 1.15 . . . . 0.79000000000000004 109.278 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HD3' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -162.01 101.11 1.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.468 1.105 . . . . 2.7599999999999998 109.279 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.802 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -59.98 133.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.457 1.098 . . . . 0.68000000000000005 109.344 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 68' ' ' ARG . 90.6 t -113.22 124.68 70.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 0.68000000000000005 109.296 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.638 ' CZ ' ' OD1' ' A' ' 58' ' ' ASP . 11.7 m-85 -75.83 166.35 23.65 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.446 1.092 . . . . 1.6100000000000001 111.025 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.408 ' O ' ' OE1' ' A' ' 38' ' ' GLU . 1.7 tm-20 -72.26 -8.01 52.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.143 . . . . 3.4199999999999999 110.308 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -95.69 10.13 37.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.524 1.14 . . . . 2.0299999999999998 109.251 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 80.78 8.47 1.21 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 4.9800000000000004 109.294 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -79.77 166.71 21.48 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.514 1.134 . . . . 1.96 110.429 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.409 ' CD ' HG22 ' A' ' 36' ' ' VAL . 2.4 mt-10 -131.93 153.11 50.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.516 1.135 . . . . 3.25 110.308 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 35' ' ' VAL . . . -99.38 33.31 6.28 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.463 1.102 . . . . 3.3900000000000001 110.966 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 46' ' ' TYR . 0.5 OUTLIER 60.35 151.8 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.51 0.77 . . . . 2.52 109.327 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 73' ' ' CYS . 0.0 OUTLIER -85.26 141.54 30.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.521 1.138 . . . . 2.4500000000000002 108.253 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.773 ' HD2' HG12 ' A' ' 56' ' ' VAL . 27.7 m-85 -150.29 135.71 18.07 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.49 1.118 . . . . 2.4199999999999999 110.995 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.46 141.73 28.41 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 0.77000000000000002 109.277 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' HB ' ' A' ' 54' ' ' THR . 44.2 t -137.15 134.06 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.134 . . . . 0.63 109.321 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -71.83 166.44 40.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 0.63 109.325 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.02 113.96 3.91 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.503 1.791 . . . . 0.72999999999999998 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.72 8.57 54.25 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.512 1.133 . . . . 0.79000000000000004 111.024 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.12 161.85 17.83 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.539 0.788 . . . . 2.4700000000000002 110.324 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.798 HG22 ' HG2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -128.7 148.32 33.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.75 109.299 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.657 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -150.38 136.29 18.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 0.92000000000000004 110.399 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.51 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.4 m -74.75 138.4 42.68 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.523 1.139 . . . . 1.1000000000000001 110.43 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.773 HG12 ' HD2' ' A' ' 46' ' ' TYR . 10.5 m -110.45 -51.28 6.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.501 1.125 . . . . 2.2400000000000002 109.323 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.633 ' HA2' ' CD2' ' A' ' 20' ' ' TYR . . . 133.09 117.4 1.82 Allowed Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.513 1.133 . . . . 3.0800000000000001 110.993 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.638 ' OD1' ' CZ ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 162.6 130.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.528 0.781 . . . . 6.9400000000000004 109.276 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -144.75 116.38 0.93 Allowed Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.49 1.119 . . . . 1.3899999999999999 110.942 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.726 ' O ' ' CG ' ' A' ' 60' ' ' TYR . 0.5 OUTLIER -78.99 50.38 1.02 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.474 0.749 . . . . 2.0299999999999998 111.03 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.876 HG23 ' HB2' ' A' ' 18' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 2.9399999999999999 109.34 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.993 0 N-CA-C 110.95 -0.86 . . . . 1.3300000000000001 110.95 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.633 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -131.79 135.43 46.76 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.503 0.766 . . . . 1.1499999999999999 109.567 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.599 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . . . -38.82 128.95 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.547 1.154 . . . . 0.94999999999999996 109.277 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' A' ' 36' ' ' VAL . 2.1 ttt180 -77.34 -49.27 15.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 5.9400000000000004 110.333 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -176.01 173.48 2.25 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.535 1.147 . . . . 1.3300000000000001 111.031 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.802 ' CD2' HG23 ' A' ' 35' ' ' VAL . 7.7 mt -96.24 135.98 37.33 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.499 1.124 . . . . 0.95999999999999996 109.277 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 6' ' ' GLU . . . -117.18 163.37 16.39 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.461 1.101 . . . . 1.1799999999999999 109.317 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HG3' ' CG ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -114.81 136.85 52.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.522 1.139 . . . . 3.1499999999999999 110.249 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 45' ' ' CYS . 1.4 t . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.497 1.123 . . . . 1.9399999999999999 108.263 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.678 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 110.332 -0.248 . . . . 3.3399999999999999 110.332 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 139.52 24.41 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.531 1.806 . . . . 0.56000000000000005 111.013 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.493 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.83 164.07 1.0 Allowed Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.12 . . . . 0.56999999999999995 109.34 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.1 Cg_endo -75.02 172.13 16.97 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.424 1.749 . . . . 0.72999999999999998 111.009 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 95.6 p -83.33 8.49 13.42 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 2.3399999999999999 110.034 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 15.7 p -110.14 29.15 7.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.51 1.131 . . . . 1.0 108.315 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 83.1 t -145.18 114.94 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 0.60999999999999999 109.326 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.6 142.62 28.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.53 1.144 . . . . 1.3600000000000001 110.362 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.686 HD21 ' HB3' ' A' ' 67' ' ' ALA . 20.1 tp -85.47 157.95 20.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.52 1.138 . . . . 1.1200000000000001 109.29 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -148.97 76.06 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.6299999999999999 111.006 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.409 ' HA ' ' OG ' ' A' ' 21' ' ' SER . 28.6 tt0 -79.93 141.5 35.99 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.475 1.11 . . . . 1.8999999999999999 110.296 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' SER . . . . . 0.473 ' O ' ' CD1' ' A' ' 60' ' ' TYR . 81.4 p -115.35 -128.24 0.29 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 1.78 109.984 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.67 ' HA ' ' CD1' ' A' ' 60' ' ' TYR . 41.2 p-90 -94.07 -68.4 0.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.561 1.163 . . . . 5.3200000000000003 108.047 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.646 ' HB2' ' CE3' ' A' ' 18' ' ' TRP . 2.1 ttp180 -118.12 37.06 4.11 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.409 1.068 . . . . 9.1500000000000004 110.289 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -177.67 159.25 1.43 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 6.2400000000000002 110.977 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.597 ' CB ' ' HB2' ' A' ' 58' ' ' ASP . 40.4 m -131.77 166.25 21.96 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.464 1.102 . . . . 2.02 109.995 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.457 ' N ' ' O ' ' A' ' 15' ' ' TYR . 1.7 tt0 -138.85 140.83 38.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.466 1.104 . . . . 2.3199999999999998 110.311 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.07 123.26 47.5 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.534 1.147 . . . . 0.52000000000000002 109.339 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.604 ' HA ' HG23 ' A' ' 53' ' ' ILE . 1.7 t0 -100.17 120.28 39.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.499 1.124 . . . . 2.0800000000000001 109.303 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.705 ' HB2' HG12 ' A' ' 48' ' ' VAL . 20.2 t-20 -78.7 101.39 7.5 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.48 1.113 . . . . 0.79000000000000004 109.361 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.24 -0.52 76.86 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.493 1.121 . . . . 0.69999999999999996 110.991 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' CYS . . . . . 0.519 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -85.32 -158.66 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.295 -1.002 . . . . 1.5900000000000001 108.295 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.462 ' HA ' ' CB ' ' A' ' 50' ' ' PRO . . . -133.4 28.47 4.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 1.0900000000000001 109.264 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -154.04 150.35 28.14 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.424 1.077 . . . . 3.25 110.309 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.496 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.2 m -73.76 127.66 33.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.435 1.085 . . . . 0.93000000000000005 110.38 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.2 m -142.25 166.61 16.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 0.81999999999999995 109.301 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.829 HG22 ' SG ' ' A' ' 45' ' ' CYS . 23.3 m -116.12 138.65 51.07 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.114 . . . . 0.91000000000000003 110.372 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.704 HG23 HD22 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -141.97 172.5 9.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.521 1.138 . . . . 0.90000000000000002 109.267 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.753 ' HE2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -148.19 118.06 7.15 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.555 1.159 . . . . 2.4300000000000002 109.288 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.819 HG11 ' OD2' ' A' ' 58' ' ' ASP . 0.4 OUTLIER -58.77 146.9 8.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.527 1.142 . . . . 0.73999999999999999 109.308 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 42' ' ' GLU . 73.4 t -126.79 123.22 62.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.558 1.161 . . . . 0.66000000000000003 109.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 89.5 m-85 -74.29 163.0 28.34 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.467 1.105 . . . . 1.55 111.014 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.2 OUTLIER -62.52 -12.07 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.512 1.132 . . . . 3.5699999999999998 110.343 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.62 5.5 35.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.484 1.115 . . . . 1.8700000000000001 109.31 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.9 OUTLIER 80.08 -2.91 1.99 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.453 1.096 . . . . 4.21 109.275 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' THR . . . . . 0.404 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.2 p -80.11 172.81 13.28 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.516 1.135 . . . . 1.3 110.396 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' GLU . . . . . 0.634 ' HG2' HG22 ' A' ' 36' ' ' VAL . 6.8 mt-10 -140.94 159.73 41.59 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.424 1.078 . . . . 1.8600000000000001 110.303 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -89.79 -99.66 1.09 Allowed Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.563 1.164 . . . . 1.9099999999999999 110.972 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.579 HD23 ' O ' ' A' ' 43' ' ' GLY . 54.6 mt -141.24 145.1 35.15 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.513 0.772 . . . . 1.6200000000000001 109.324 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' CYS . . . . . 0.829 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.7 OUTLIER -81.05 131.54 35.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.544 1.153 . . . . 1.8 108.302 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.751 ' HB2' HG12 ' A' ' 56' ' ' VAL . 28.8 m-85 -138.92 145.34 39.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.102 . . . . 2.02 110.969 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.47 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -94.15 129.83 40.58 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.508 1.13 . . . . 0.56000000000000005 109.278 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.861 HG22 ' HB ' ' A' ' 54' ' ' THR . 50.9 t -124.79 144.93 33.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.489 1.118 . . . . 0.38 109.291 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ALA . . . . . 0.572 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -89.75 166.76 19.45 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.541 1.151 . . . . 0.72999999999999998 109.315 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.572 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 123.18 7.7 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.504 1.792 . . . . 1.05 111.013 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.01 21.74 41.16 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 124.527 1.142 . . . . 1.1899999999999999 110.994 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.943 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -134.2 169.81 16.62 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.518 0.775 . . . . 2.8900000000000001 110.305 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.943 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -136.74 138.13 46.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 1.1000000000000001 109.268 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.861 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -138.11 140.91 40.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.478 1.111 . . . . 0.94999999999999996 110.438 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' THR . . . . . 0.479 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.5 m -84.9 127.31 34.1 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.468 1.105 . . . . 1.49 110.387 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.751 HG12 ' HB2' ' A' ' 46' ' ' TYR . 3.9 m -101.75 -42.89 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.477 1.11 . . . . 2.6200000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.551 ' O ' ' CB ' ' A' ' 58' ' ' ASP . . . 138.79 159.4 8.03 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.553 1.158 . . . . 2.46 110.985 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.819 ' OD2' HG11 ' A' ' 35' ' ' VAL . 2.4 m-20 152.03 -171.2 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.46 0.741 . . . . 6.4900000000000002 109.291 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.553 ' HA2' ' O ' ' A' ' 18' ' ' TRP . . . 174.73 118.46 0.52 Allowed Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.495 1.122 . . . . 1.9099999999999999 111.008 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.67 ' CD1' ' HA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -101.9 11.75 38.08 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.507 0.769 . . . . 3.5299999999999998 111.057 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ILE . . . . . 0.675 ' H ' HD13 ' A' ' 61' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.461 0 O-C-N 124.5 1.125 . . . . 3.0899999999999999 109.265 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' GLY . . . . . . . . 0 CA--C 1.53 0.969 0 N-CA-C 111.009 -0.836 . . . . 1.3400000000000001 111.009 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.503 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -126.68 131.61 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 0.735 . . . . 2.0600000000000001 109.634 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.686 ' HB3' HD21 ' A' ' 14' ' ' LEU . . . -38.47 119.78 0.85 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 0.73999999999999999 109.284 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 38' ' ' GLU . 7.6 ttp85 -78.69 -44.27 24.0 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 5.1799999999999997 110.308 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 69' ' ' TYR . 7.8 p90 -176.43 167.88 2.76 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.517 1.135 . . . . 1.0 111.0 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.769 HD23 ' HA ' ' A' ' 35' ' ' VAL . 14.4 mt -101.2 147.29 26.44 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.533 1.146 . . . . 1.6100000000000001 109.329 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.753 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . . . -131.33 149.04 52.72 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.524 1.14 . . . . 0.56999999999999995 109.267 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -88.72 150.73 22.83 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 1.108 . . . . 3.71 110.277 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.5 m . . . . . 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 2.3100000000000001 108.301 -179.989 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.427 ' O ' ' N ' ' A' ' 3' ' ' THR . 10.3 t0 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.313 -0.625 . . . . 14.210000000000001 109.313 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.509 HG22 ' N ' ' A' ' 3' ' ' THR . 5.9 m 44.22 -96.21 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 1.104 . . . . 14.390000000000001 110.393 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.509 ' N ' HG22 ' A' ' 2' ' ' THR . 0.9 OUTLIER -117.69 129.13 55.54 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 13.029999999999999 110.391 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -148.18 136.87 15.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 7.7800000000000002 109.327 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.53 ' O ' ' CB ' ' A' ' 6' ' ' GLU . 1.4 m -54.79 -93.21 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 3.3100000000000001 109.985 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.53 ' CB ' ' O ' ' A' ' 5' ' ' SER . 4.7 tt0 88.23 142.69 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 3.7400000000000002 110.322 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 6' ' ' GLU . 18.3 Cg_endo -74.99 144.8 30.71 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.507 1.793 . . . . 0.83999999999999997 111.008 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -61.18 173.21 0.75 Allowed Pre-proline 0 C--N 1.326 -0.428 0 O-C-N 124.509 1.131 . . . . 0.66000000000000003 109.325 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -74.99 172.13 16.96 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.526 1.803 . . . . 0.93999999999999995 111.004 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.51 11.16 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 2.1899999999999999 110.037 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 26' ' ' GLY . 7.9 p -108.29 20.75 18.25 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.533 1.146 . . . . 0.97999999999999998 108.261 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.726 HG13 ' O ' ' A' ' 24' ' ' ASP . 43.9 t -138.28 131.46 40.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.565 1.166 . . . . 0.92000000000000004 109.27 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' LEU . 1.1 m -97.92 167.02 11.17 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.498 1.124 . . . . 2.23 110.389 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 1.013 HD13 HD21 ' A' ' 70' ' ' LEU . 14.7 tp -123.76 130.91 53.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.69999999999999996 109.267 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -115.67 70.14 0.74 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 1.125 . . . . 1.29 110.985 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -91.92 102.19 14.76 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.493 1.121 . . . . 1.3999999999999999 110.284 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' CA ' ' A' ' 59' ' ' GLY . 10.5 p -106.68 -152.92 0.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 1.9199999999999999 110.007 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.613 ' O ' HD12 ' A' ' 61' ' ' ILE . 55.7 p-90 -93.35 -27.54 16.71 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.496 1.122 . . . . 2.6299999999999999 107.981 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -77.2 -61.64 1.92 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 6.1900000000000004 110.337 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 2.6 p90 -159.25 177.09 11.4 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.125 . . . . 8.1199999999999992 110.998 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.498 ' O ' HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -106.77 132.97 52.13 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.544 1.153 . . . . 2.1400000000000001 110.036 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.804 ' OE1' HG22 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -120.65 142.9 49.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 2.6000000000000001 110.286 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.741 ' CB ' HG11 ' A' ' 56' ' ' VAL . . . -112.7 123.75 51.0 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.509 1.131 . . . . 0.59999999999999998 109.259 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.726 ' O ' HG13 ' A' ' 12' ' ' VAL . 39.6 t0 -107.47 126.15 52.15 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.469 1.106 . . . . 2.3100000000000001 109.332 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.534 ' CB ' HG12 ' A' ' 48' ' ' VAL . 56.5 t-20 -94.04 89.67 6.12 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.543 1.152 . . . . 0.67000000000000004 109.309 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -81.27 8.34 58.35 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.525 1.14 . . . . 1.02 110.981 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -179.99 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.301 -1.0 . . . . 1.8 108.301 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.444 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -115.49 21.25 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 1.1299999999999999 109.294 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.474 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.5 mt-10 -154.02 137.99 16.34 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.464 1.102 . . . . 2.1299999999999999 110.301 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.417 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.8 m -51.72 130.3 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.533 1.146 . . . . 0.92000000000000004 110.455 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 29' ' ' GLU . 20.9 m -140.29 153.65 22.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 0.68000000000000005 109.287 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.82 HG22 ' SG ' ' A' ' 45' ' ' CYS . 54.8 m -113.15 133.13 55.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.56 1.163 . . . . 0.81000000000000005 110.397 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 1.4 m -135.24 179.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.72999999999999998 109.275 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 13.6 pttm -159.7 108.88 1.81 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.544 1.152 . . . . 2.5699999999999998 109.253 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 1.048 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.59 114.59 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 0.52000000000000002 109.311 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.785 HG22 ' HG2' ' A' ' 42' ' ' GLU . 19.4 t -97.33 121.18 47.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 0.73999999999999999 109.289 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -78.89 178.62 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.489 1.118 . . . . 0.93000000000000005 111.021 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 0.4 OUTLIER -84.61 -9.77 57.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.487 1.117 . . . . 3.2000000000000002 110.273 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.489 ' HB2' ' CG2' ' A' ' 41' ' ' THR . 0.0 OUTLIER -81.59 0.93 36.12 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.546 1.154 . . . . 2.0800000000000001 109.299 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.488 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 81.52 31.0 0.13 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.15 . . . . 3.6800000000000002 109.317 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.489 ' CG2' ' HB2' ' A' ' 39' ' ' ASP . 0.2 OUTLIER -124.44 174.28 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 2.04 110.392 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.785 ' HG2' HG22 ' A' ' 36' ' ' VAL . 1.7 mp0 -135.84 151.24 49.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.511 1.132 . . . . 2.6800000000000002 110.3 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.601 ' O ' ' CE2' ' A' ' 46' ' ' TYR . . . -87.78 46.51 3.45 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 124.55 1.156 . . . . 3.2400000000000002 111.019 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.98 154.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 0.754 . . . . 2.23 109.301 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.82 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.8 OUTLIER -91.1 123.07 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 1.99 108.298 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CE2' ' O ' ' A' ' 43' ' ' GLY . 25.8 m-85 -124.93 137.59 54.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.48 1.112 . . . . 2.3900000000000001 110.971 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.85 130.21 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.117 . . . . 0.70999999999999996 109.277 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.534 HG12 ' CB ' ' A' ' 25' ' ' ASN . 40.6 t -126.81 138.02 56.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.56999999999999995 109.285 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.733 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -81.07 172.9 8.65 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 0.90000000000000002 109.291 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.733 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.08 99.32 1.24 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.522 1.801 . . . . 0.79000000000000004 110.979 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.3 30.13 3.22 Favored Glycine 0 CA--C 1.53 1.001 0 O-C-N 124.496 1.122 . . . . 1.1499999999999999 110.982 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.973 ' O ' HD13 ' A' ' 53' ' ' ILE . 6.0 tt0 -125.49 153.29 43.78 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.465 0.744 . . . . 3.4199999999999999 110.327 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.973 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -139.33 120.77 15.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.51 1.131 . . . . 1.3400000000000001 109.333 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -143.04 154.66 44.2 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.094 . . . . 1.52 110.415 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -61.88 146.68 49.05 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.526 1.142 . . . . 1.2 110.398 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.741 HG11 ' CB ' ' A' ' 23' ' ' ALA . 29.2 m -139.33 11.12 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.52 1.137 . . . . 2.5699999999999998 109.293 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 170.38 -169.58 42.39 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.457 1.098 . . . . 2.3799999999999999 110.947 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.446 ' C ' ' HA ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -104.42 -170.73 1.81 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.471 0.748 . . . . 5.8499999999999996 109.299 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.427 ' CA ' ' O ' ' A' ' 17' ' ' SER . . . -88.27 175.05 44.2 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.507 1.129 . . . . 1.3400000000000001 110.969 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' ND1' ' A' ' 66' ' ' HIS . 0.6 OUTLIER -94.2 36.04 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.474 0.75 . . . . 2.27 111.022 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.18 -8.42 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 2.6899999999999999 109.283 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.42 4.72 17.48 Favored Glycine 0 CA--C 1.529 0.959 0 O-C-N 124.53 1.144 . . . . 2.29 111.02 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.3 m -59.3 -98.57 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.483 0.755 . . . . 4.2000000000000002 109.987 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.415 ' O ' ' OD1' ' A' ' 39' ' ' ASP . 0.4 OUTLIER -91.59 33.11 1.03 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.466 1.104 . . . . 1.97 109.63 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.97 -147.35 21.78 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.518 1.137 . . . . 1.1799999999999999 111.017 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.427 ' ND1' ' HB2' ' A' ' 60' ' ' TYR . 5.3 m-70 -125.15 116.28 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 0.765 . . . . 1.26 109.598 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -40.6 118.63 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.528 1.142 . . . . 0.60999999999999999 109.312 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -78.01 -45.39 23.85 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 5.9900000000000002 110.269 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 68' ' ' ARG . 5.2 p90 177.21 166.94 0.58 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 1.4199999999999999 111.002 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 1.048 ' CD2' HG23 ' A' ' 35' ' ' VAL . 10.9 mt -85.06 136.46 33.56 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.548 1.155 . . . . 1.1799999999999999 109.319 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.554 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.6 138.05 51.72 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.542 1.151 . . . . 0.57999999999999996 109.309 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -81.29 147.19 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.474 1.109 . . . . 3.77 110.306 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -4.33 49.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.484 1.115 . . . . 2.5099999999999998 108.292 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 14.3 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.997 -1.477 . . . . 5.9800000000000004 109.276 -179.977 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.429 ' O ' ' CB ' ' A' ' 2' ' ' THR . 9.9 p-10 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.312 -0.625 . . . . 13.43 109.312 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 1' ' ' ASP . 0.9 OUTLIER 171.51 -34.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.51 1.131 . . . . 10.16 110.378 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.5 p -42.39 121.32 1.9 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.551 1.157 . . . . 7.04 110.401 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 m 40.06 40.71 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.46 1.1 . . . . 7.9400000000000004 109.28 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -177.2 -156.33 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.428 1.08 . . . . 3.3199999999999998 110.024 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -170.5 141.97 1.66 Allowed Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.121 . . . . 3.2599999999999998 110.299 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.99 149.41 36.71 Favored 'Trans proline' 0 C--N 1.36 1.136 0 O-C-N 124.49 1.784 . . . . 1.1799999999999999 110.954 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -84.77 166.56 31.42 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.133 . . . . 0.69999999999999996 109.316 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.01 173.01 15.26 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.473 1.775 . . . . 0.93000000000000005 110.977 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.1 9.74 29.7 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.539 1.149 . . . . 3.3599999999999999 110.0 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 9' ' ' PRO . 11.8 p -91.05 -36.8 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 2.0899999999999999 108.312 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 33' ' ' VAL . 84.5 t -79.08 115.51 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.63 109.29 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.414 ' OG1' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -83.59 158.12 22.04 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.499 1.124 . . . . 0.97999999999999998 110.404 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.716 HD13 HD21 ' A' ' 70' ' ' LEU . 11.4 tp -113.13 112.22 23.44 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.48 1.113 . . . . 0.68999999999999995 109.292 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.483 ' HB3' ' CB ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -96.19 59.22 1.9 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.518 1.136 . . . . 1.9099999999999999 110.963 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 21' ' ' SER . 6.1 tt0 -78.23 117.83 19.87 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.467 1.104 . . . . 1.52 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.531 ' OG ' ' O ' ' A' ' 20' ' ' TYR . 6.4 p -107.88 -149.36 0.43 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.557 1.16 . . . . 1.1899999999999999 110.001 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.653 ' CE3' ' N ' ' A' ' 19' ' ' ARG . 24.3 p-90 -106.68 -42.81 4.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.499 1.124 . . . . 2.25 108.03 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.653 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -78.31 -33.25 49.42 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 8.1199999999999992 110.339 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.65 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER -167.4 160.08 13.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.136 . . . . 8.4299999999999997 110.979 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.594 ' O ' HG22 ' A' ' 55' ' ' THR . 5.6 m -112.22 144.22 41.99 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.511 1.132 . . . . 2.6200000000000001 110.003 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 1.7 tt0 -126.77 172.75 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.12 . . . . 1.8100000000000001 110.307 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.41 125.15 22.4 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.56 1.163 . . . . 0.60999999999999999 109.273 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' O ' HG13 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -97.89 137.34 36.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 2.5 109.264 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.48 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 34.9 t-20 -95.69 81.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.78000000000000003 109.252 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.84 20.52 27.93 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.502 1.126 . . . . 1.1599999999999999 110.989 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' O ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -94.05 10.11 34.95 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.28 -1.007 . . . . 3.0099999999999998 108.28 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.466 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.88 32.68 0.11 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.448 1.092 . . . . 2.0 109.327 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -163.03 138.68 6.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.52 1.138 . . . . 2.0299999999999998 110.299 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -54.62 118.95 4.61 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.96999999999999997 110.423 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.461 HG13 ' O ' ' A' ' 29' ' ' GLU . 34.2 m -143.88 173.4 5.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.485 1.116 . . . . 0.57999999999999996 109.281 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.424 HG23 ' C ' ' A' ' 46' ' ' TYR . 60.0 m -124.56 141.97 51.69 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 0.71999999999999997 110.424 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -141.91 175.34 5.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.092 . . . . 0.63 109.275 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.992 ' CG ' ' HB3' ' A' ' 71' ' ' ALA . 16.0 ptmt -156.6 112.01 2.9 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 3.0800000000000001 109.309 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -56.48 132.4 20.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 0.53000000000000003 109.26 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.874 HG11 ' CZ ' ' A' ' 69' ' ' TYR . 78.6 t -116.96 118.64 59.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 0.77000000000000002 109.328 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.607 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 74.1 m-85 -76.44 166.33 23.57 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.505 1.128 . . . . 0.90000000000000002 111.018 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.486 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.91 -9.77 32.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.53 1.144 . . . . 3.0899999999999999 110.312 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -90.47 19.09 5.51 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.142 . . . . 2.6600000000000001 109.344 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.72 13.72 5.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.471 1.107 . . . . 4.2300000000000004 109.291 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -93.31 161.94 14.2 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.139 . . . . 1.0900000000000001 110.401 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.1 mt-10 -135.52 146.08 47.71 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 2.8100000000000001 110.334 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.71 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -73.14 -92.63 0.11 Allowed Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.475 1.109 . . . . 1.8400000000000001 110.967 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 43' ' ' GLY . 42.4 mt -153.31 144.45 23.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.446 0.733 . . . . 1.25 109.306 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.9 m -75.75 105.5 6.82 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.566 1.166 . . . . 2.2799999999999998 108.327 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.424 ' C ' HG23 ' A' ' 32' ' ' THR . 8.1 m-30 -112.97 142.12 46.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.518 1.136 . . . . 1.99 110.979 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.22 122.8 40.65 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.471 1.107 . . . . 0.42999999999999999 109.31 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 ' HB ' ' A' ' 54' ' ' THR . 74.8 t -113.71 140.68 32.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.513 1.133 . . . . 0.34999999999999998 109.281 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.828 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.8 177.54 2.93 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 0.56000000000000005 109.314 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.828 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.4 Cg_endo -74.99 108.49 2.73 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.486 1.782 . . . . 1.02 111.002 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.66 6.41 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.441 1.088 . . . . 0.73999999999999999 111.027 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.894 ' C ' HD13 ' A' ' 53' ' ' ILE . 12.1 tt0 -134.98 157.84 45.88 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.462 0.742 . . . . 2.2200000000000002 110.34 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.894 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -130.22 137.22 56.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.523 1.139 . . . . 1.0700000000000001 109.286 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.524 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -143.68 143.64 31.52 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 0.79000000000000004 110.445 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.2 131.96 45.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.489 1.118 . . . . 1.2 110.422 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.511 HG23 ' HB ' ' A' ' 35' ' ' VAL . 12.2 m -119.09 -10.13 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.476 1.11 . . . . 1.98 109.253 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -171.41 -172.88 37.94 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.501 1.125 . . . . 2.4199999999999999 111.026 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.503 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.5 m-20 -90.11 -166.32 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.504 0.767 . . . . 6.2699999999999996 109.279 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -86.56 170.47 42.38 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.5 1.125 . . . . 1.6399999999999999 111.021 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.631 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 0.0 OUTLIER -92.6 40.99 1.06 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.517 0.775 . . . . 2.4199999999999999 111.012 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.637 HG23 ' O ' ' A' ' 18' ' ' TRP . 0.1 OUTLIER -78.2 -4.5 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.461 1.101 . . . . 2.75 109.324 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 113.13 5.06 23.63 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.521 1.138 . . . . 2.48 111.029 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 64' ' ' HIS . 94.2 p -59.18 -97.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.465 0.744 . . . . 4.6600000000000001 110.023 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.607 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -90.58 25.59 2.26 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.53 1.144 . . . . 2.0600000000000001 109.637 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 92.27 -156.23 23.33 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.532 1.145 . . . . 1.1499999999999999 110.998 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.631 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.1 OUTLIER -124.52 119.16 28.32 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.541 0.789 . . . . 1.26 109.56 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 35' ' ' VAL . . . -45.2 108.79 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.491 1.119 . . . . 1.01 109.316 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -77.51 -31.2 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.489 1.118 . . . . 4.5700000000000003 110.314 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.874 ' CZ ' HG11 ' A' ' 36' ' ' VAL . 15.7 p90 -173.93 175.69 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.503 1.127 . . . . 1.1299999999999999 110.973 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.716 HD21 HD13 ' A' ' 14' ' ' LEU . 51.7 mt -106.41 140.2 39.7 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.466 1.104 . . . . 1.1000000000000001 109.294 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.992 ' HB3' ' CG ' ' A' ' 34' ' ' LYS . . . -107.78 142.79 37.27 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.538 1.149 . . . . 0.54000000000000004 109.342 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -87.63 139.92 30.05 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 3.7999999999999998 110.279 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.85 123.71 35.77 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 2.75 108.3 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.001 -1.476 . . . . 5.1299999999999999 109.285 -179.991 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 2' ' ' THR . 9.2 t0 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.32 -0.622 . . . . 13.56 109.32 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.58 HG23 ' H ' ' A' ' 3' ' ' THR . 0.0 OUTLIER 29.96 -96.8 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.44 1.088 . . . . 9.4800000000000004 110.443 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.58 ' H ' HG23 ' A' ' 2' ' ' THR . 9.4 t -160.48 156.47 26.01 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.535 1.147 . . . . 8.2100000000000009 110.401 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.445 HG23 HG23 ' A' ' 3' ' ' THR . 25.5 t 68.07 83.44 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.492 1.12 . . . . 7.96 109.336 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -77.65 0.17 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 3.1800000000000002 110.015 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.18 95.59 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 3.9900000000000002 110.29 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 142.65 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.517 1.798 . . . . 0.55000000000000004 111.03 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.32 158.48 56.69 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.499 1.125 . . . . 0.59999999999999998 109.3 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 171.36 18.47 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.472 1.775 . . . . 0.71999999999999997 110.969 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -85.41 9.13 16.49 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.491 1.12 . . . . 2.2200000000000002 109.982 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.8 p -104.74 23.19 13.81 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.509 1.131 . . . . 1.01 108.298 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 24' ' ' ASP . 84.7 t -146.03 116.02 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.461 1.1 . . . . 0.60999999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.435 ' N ' ' O ' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -81.24 161.81 23.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 0.98999999999999999 110.44 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.576 HD13 HG23 ' A' ' 35' ' ' VAL . 16.1 tp -118.63 106.08 12.25 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.481 1.113 . . . . 0.60999999999999999 109.292 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.725 ' HD2' HG21 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -87.24 61.72 6.85 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.475 1.109 . . . . 1.6299999999999999 110.98 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.655 ' CD ' ' HB3' ' A' ' 67' ' ' ALA . 5.2 tt0 -78.24 96.84 5.34 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.572 1.17 . . . . 1.3799999999999999 110.327 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.34 -163.0 0.93 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 2.3199999999999998 109.996 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.69 ' HB2' HG21 ' A' ' 61' ' ' ILE . 66.1 p-90 -99.14 -49.79 4.37 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.479 1.112 . . . . 2.8100000000000001 108.045 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.577 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.03 -21.11 59.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 6.8300000000000001 110.284 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' CB ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -166.87 175.51 7.68 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.577 1.173 . . . . 5.5599999999999996 110.976 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 55' ' ' THR . 6.0 m -141.58 138.5 32.69 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 2.6800000000000002 109.968 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -137.66 -179.97 6.07 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.57 1.169 . . . . 2.3300000000000001 110.284 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -134.03 129.95 36.83 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.68999999999999995 109.33 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.634 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -95.12 136.25 35.67 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.555 1.16 . . . . 4.6299999999999999 109.301 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.475 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.0 t-20 -96.49 87.22 4.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.093 . . . . 0.45000000000000001 109.301 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.44 13.04 53.58 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.526 1.141 . . . . 0.56999999999999995 110.985 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.2 -155.64 0.33 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.328 -0.99 . . . . 1.6000000000000001 108.328 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.59 20.98 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.117 . . . . 1.1399999999999999 109.313 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.408 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -155.95 152.26 27.99 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 2.96 110.29 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.1 m -65.8 125.64 25.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 0.71999999999999997 110.353 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.24 159.52 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.424 1.077 . . . . 0.52000000000000002 109.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.556 HG22 ' HB2' ' A' ' 73' ' ' CYS . 67.1 m -114.58 143.71 44.56 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 0.65000000000000002 110.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.442 HG23 HD22 ' A' ' 70' ' ' LEU . 3.4 m -141.09 177.84 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 0.68000000000000005 109.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.617 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -154.96 105.53 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 1.9099999999999999 109.291 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.727 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -53.7 116.01 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 0.67000000000000004 109.3 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.883 HG22 ' HG2' ' A' ' 42' ' ' GLU . 23.2 t -99.39 120.36 48.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.461 1.101 . . . . 0.51000000000000001 109.292 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CG ' ' O ' ' A' ' 64' ' ' HIS . 96.4 m-85 -83.94 167.92 16.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 1.0900000000000001 110.939 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.501 ' CG ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -58.47 -21.5 51.76 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.472 1.108 . . . . 3.98 110.286 179.986 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -79.82 3.56 19.24 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.533 1.146 . . . . 2.29 109.313 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 75.22 3.06 4.02 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.485 1.116 . . . . 4.2199999999999998 109.281 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.619 HG21 ' HE1' ' A' ' 64' ' ' HIS . 1.4 p -78.73 144.94 34.78 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.492 1.12 . . . . 0.87 110.404 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.883 ' HG2' HG22 ' A' ' 36' ' ' VAL . 0.4 OUTLIER -121.36 142.38 50.04 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.497 1.123 . . . . 2.48 110.299 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.704 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -60.88 -106.65 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.484 1.115 . . . . 1.8300000000000001 110.961 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 43' ' ' GLY . 47.2 mt -153.02 140.15 19.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 0.773 . . . . 1.28 109.304 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.8 m -42.8 101.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 1.106 . . . . 1.8600000000000001 108.298 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 2.6 m-85 -108.98 111.91 23.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.46 1.1 . . . . 2.3999999999999999 111.031 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.83 128.84 35.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.52 1.138 . . . . 0.55000000000000004 109.332 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.663 HG22 ' HB ' ' A' ' 54' ' ' THR . 69.6 t -128.79 140.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.465 1.103 . . . . 0.33000000000000002 109.356 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.686 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.51 171.77 11.5 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.515 1.134 . . . . 0.46999999999999997 109.292 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.686 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.5 Cg_endo -74.97 102.52 1.6 Allowed 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.475 1.776 . . . . 0.66000000000000003 111.044 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 105.13 36.55 2.89 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.507 1.129 . . . . 0.66000000000000003 110.989 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.748 ' C ' HD13 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -144.94 158.27 43.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.545 0.791 . . . . 2.2400000000000002 110.291 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.748 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -126.68 141.75 45.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.444 1.09 . . . . 0.95999999999999996 109.326 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.663 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -146.45 141.31 27.0 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.476 1.11 . . . . 0.76000000000000001 110.376 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.58 141.5 54.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 1.25 110.408 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 15.3 m -129.59 1.21 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 2.3700000000000001 109.311 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 21' ' ' SER . . . 164.37 -173.48 40.34 Favored Glycine 0 CA--C 1.529 0.962 0 O-C-N 124.55 1.156 . . . . 2.2999999999999998 111.048 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.434 ' N ' ' OH ' ' A' ' 37' ' ' TYR . 7.9 m-20 -92.61 -173.58 3.4 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 0.777 . . . . 5.8700000000000001 109.305 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 63' ' ' SER . . . -83.68 -176.78 51.44 Favored Glycine 0 CA--C 1.53 0.98 0 O-C-N 124.551 1.157 . . . . 1.22 111.03 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 3.9 p90 -101.13 27.95 5.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.501 0.765 . . . . 2.6899999999999999 111.016 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.69 HG21 ' HB2' ' A' ' 18' ' ' TRP . 1.3 pp -93.36 51.48 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.512 1.132 . . . . 2.8100000000000001 109.317 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 63' ' ' SER . . . 88.74 -1.3 83.49 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.508 1.13 . . . . 2.2000000000000002 111.027 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 59' ' ' GLY . 1.1 m -60.4 -138.32 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.499 0.764 . . . . 5.4900000000000002 109.987 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.619 ' HE1' HG21 ' A' ' 41' ' ' THR . 1.0 OUTLIER -79.44 37.48 0.34 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.544 1.152 . . . . 2.0699999999999998 109.615 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.454 ' H ' ' C ' ' A' ' 63' ' ' SER . . . 91.87 -161.69 27.11 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.49 1.119 . . . . 1.28 111.004 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.408 ' O ' ' C ' ' A' ' 67' ' ' ALA . 2.3 m-70 -107.93 107.0 17.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 0.764 . . . . 2.4500000000000002 109.589 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.655 ' HB3' ' CD ' ' A' ' 16' ' ' GLN . . . -39.66 113.18 0.31 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.493 1.12 . . . . 0.60999999999999999 109.28 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -78.14 -38.34 43.95 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.119 . . . . 6.0899999999999999 110.317 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.502 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 18.1 p90 179.53 -166.12 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.492 1.12 . . . . 1.1299999999999999 111.02 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 35' ' ' VAL . 70.9 mt -115.24 138.24 51.16 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.527 1.142 . . . . 1.26 109.32 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.617 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.42 139.4 50.48 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.499 1.124 . . . . 0.60999999999999999 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.8 147.3 51.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.536 1.147 . . . . 3.1699999999999999 110.344 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.556 ' HB2' HG22 ' A' ' 32' ' ' THR . 40.7 t -79.57 -102.06 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.461 1.101 . . . . 2.6600000000000001 108.307 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-O 116.974 -1.488 . . . . 7.21 109.261 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.309 -0.626 . . . . 14.43 109.309 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.3 p 40.48 75.17 0.09 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.512 1.133 . . . . 11.359999999999999 110.44 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.549 HG23 ' O ' ' A' ' 3' ' ' THR . 13.5 t -115.11 49.0 1.09 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.446 1.091 . . . . 9.0 110.361 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.9 m -123.72 108.32 20.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.143 . . . . 7.5599999999999996 109.278 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.01 -149.59 0.43 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.506 1.129 . . . . 3.79 109.97 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.418 ' CG ' ' HB2' ' A' ' 72' ' ' ARG . 43.1 tp10 -153.63 102.11 2.54 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 3.4199999999999999 110.282 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 139.6 24.46 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.524 1.802 . . . . 0.67000000000000004 110.998 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.622 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 168.45 0.95 Allowed Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 0.60999999999999999 109.313 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.622 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.3 Cg_endo -75.0 170.0 21.39 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.518 1.799 . . . . 0.80000000000000004 111.004 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.54 13.31 12.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 2.2799999999999998 110.024 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.2 p -112.65 21.46 15.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.492 1.12 . . . . 0.95999999999999996 108.294 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.592 HG22 ' HA ' ' A' ' 25' ' ' ASN . 3.1 t -139.5 123.04 18.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 0.67000000000000004 109.28 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 154.31 19.21 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.436 1.085 . . . . 1.1000000000000001 110.409 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.966 HD13 HD21 ' A' ' 70' ' ' LEU . 6.1 tp -108.07 111.96 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 0.54000000000000004 109.319 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -93.23 58.06 2.8 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 1.51 110.97 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.55 ' HB2' HD11 ' A' ' 14' ' ' LEU . 4.8 tt0 -74.48 98.43 3.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.52 1.138 . . . . 1.51 110.311 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.493 ' HG ' ' H ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -92.6 -160.84 0.78 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.483 1.115 . . . . 1.22 109.998 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.825 ' O ' HD11 ' A' ' 61' ' ' ILE . 29.8 p-90 -99.5 -46.48 5.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 2.8900000000000001 107.97 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -71.67 -34.24 69.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 5.7400000000000002 110.307 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.567 ' CD2' HG21 ' A' ' 55' ' ' THR . 0.1 OUTLIER -167.45 157.29 10.62 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.138 . . . . 6.0700000000000003 111.005 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 2.8 t -105.94 134.96 48.23 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 1.9199999999999999 110.01 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.566 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 9.5 mt-30 -125.74 172.15 10.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 2.0800000000000001 110.259 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.795 ' HB2' HG11 ' A' ' 56' ' ' VAL . . . -134.76 129.23 34.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.523 1.14 . . . . 0.5 109.301 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 25' ' ' ASN . 2.8 t0 -102.65 133.46 47.62 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 2.2000000000000002 109.288 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.592 ' HA ' HG22 ' A' ' 12' ' ' VAL . 60.8 t-20 -93.67 93.77 8.21 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.489 1.118 . . . . 0.5 109.262 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.51 9.6 70.23 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.519 1.137 . . . . 0.60999999999999999 110.993 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.55 -167.71 1.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 1.6399999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.422 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -125.2 25.44 7.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.576 1.173 . . . . 1.1499999999999999 109.3 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.411 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 10.3 mt-10 -158.09 144.82 17.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.502 1.126 . . . . 2.2999999999999998 110.28 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.0 m -61.78 128.89 38.41 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.454 1.096 . . . . 0.73999999999999999 110.359 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.21 162.25 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.497 1.123 . . . . 0.52000000000000002 109.282 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.495 HG22 ' HB2' ' A' ' 73' ' ' CYS . 49.0 m -111.94 143.61 42.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.469 1.106 . . . . 0.54000000000000004 110.405 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.438 HG11 HG11 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -140.71 177.94 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.453 1.096 . . . . 0.54000000000000004 109.318 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -160.67 110.48 1.73 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.55 1.156 . . . . 2.02 109.329 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.804 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -61.88 114.35 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.46 1.1 . . . . 0.71999999999999997 109.273 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.952 HG22 ' HG2' ' A' ' 42' ' ' GLU . 84.7 t -96.05 117.62 40.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.502 1.126 . . . . 0.5 109.286 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 25.2 m-85 -75.45 173.47 10.92 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 1.72 111.048 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 1.8 mm-40 -81.16 -12.06 59.3 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.462 1.102 . . . . 3.6400000000000001 110.255 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.457 ' CG ' ' OG1' ' A' ' 41' ' ' THR . 5.2 p-10 -93.73 34.0 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.102 . . . . 2.6499999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.44 ' O ' HG23 ' A' ' 41' ' ' THR . 1.7 m-20 46.96 67.38 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.133 . . . . 4.2599999999999998 109.306 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.457 ' OG1' ' CG ' ' A' ' 39' ' ' ASP . 1.0 OUTLIER -152.29 152.16 31.81 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.463 1.102 . . . . 0.92000000000000004 110.357 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.9 mt-10 -130.9 139.58 50.11 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 2.0499999999999998 110.313 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -58.95 -103.94 0.01 OUTLIER Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.537 1.148 . . . . 1.72 110.996 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.685 HD23 ' O ' ' A' ' 43' ' ' GLY . 45.1 mt -153.6 139.66 18.3 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 1.3200000000000001 109.319 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.7 m -51.53 103.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.496 1.123 . . . . 1.6299999999999999 108.328 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 33.2 m-85 -112.05 122.87 48.96 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 1.72 111.017 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.67 123.77 38.3 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.493 1.121 . . . . 0.5 109.301 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 25' ' ' ASN . 68.2 t -122.36 138.34 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.499 1.124 . . . . 0.35999999999999999 109.318 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.726 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.93 173.51 7.61 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.52 1.137 . . . . 0.48999999999999999 109.35 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.726 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 97.74 1.1 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.487 1.783 . . . . 0.65000000000000002 111.0 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 109.9 35.27 2.22 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.507 1.13 . . . . 0.80000000000000004 110.967 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.723 ' C ' HD13 ' A' ' 53' ' ' ILE . 4.1 mt-30 -140.05 159.48 42.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.511 0.771 . . . . 3.54 110.289 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.723 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -128.82 140.27 49.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 O-C-N 124.496 1.122 . . . . 0.98999999999999999 109.284 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.544 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.6 OUTLIER -148.05 147.76 29.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.556 1.16 . . . . 0.95999999999999996 110.418 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.567 HG21 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -60.94 146.15 47.83 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.508 1.13 . . . . 1.6299999999999999 110.427 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.795 HG11 ' HB2' ' A' ' 23' ' ' ALA . 29.5 m -132.64 -0.54 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.479 1.112 . . . . 2.6600000000000001 109.332 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 162.52 -169.46 37.8 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.519 1.137 . . . . 2.25 111.014 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.51 ' O ' ' CB ' ' A' ' 21' ' ' SER . 4.4 m-20 -89.67 -164.63 1.18 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.513 0.773 . . . . 5.6699999999999999 109.309 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -86.53 -169.06 45.54 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.514 1.134 . . . . 1.1399999999999999 111.007 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.649 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 18.5 p90 -90.86 -7.09 53.23 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.537 0.786 . . . . 1.9199999999999999 110.975 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.825 HD11 ' O ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -101.82 9.35 8.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.552 1.158 . . . . 2.9500000000000002 109.32 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.28 -163.64 31.16 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 124.493 1.121 . . . . 3.1099999999999999 111.017 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.2 -15.14 27.96 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.54 0.788 . . . . 4.4400000000000004 109.996 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.602 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -86.29 8.76 20.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.489 1.118 . . . . 2.6200000000000001 109.574 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.0 -136.72 21.03 Favored Glycine 0 CA--C 1.53 1.016 0 O-C-N 124.534 1.146 . . . . 0.83999999999999997 111.011 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.649 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -118.82 131.29 56.09 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.535 0.785 . . . . 1.22 109.644 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.452 ' HB3' ' NE2' ' A' ' 16' ' ' GLN . . . -46.33 122.59 4.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.67000000000000004 109.309 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -77.9 -47.38 18.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.575 1.172 . . . . 5.5 110.287 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CE2' ' HD2' ' A' ' 68' ' ' ARG . 6.2 p90 -174.85 -177.5 1.13 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.496 1.123 . . . . 1.0600000000000001 110.988 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.966 HD21 HD13 ' A' ' 14' ' ' LEU . 7.9 mt -105.69 135.05 47.8 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.551 1.157 . . . . 1.51 109.28 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 6' ' ' GLU . . . -123.19 148.52 45.71 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.507 1.129 . . . . 0.54000000000000004 109.295 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB2' ' CG ' ' A' ' 6' ' ' GLU . 3.6 mtt180 -81.3 154.49 26.51 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.511 1.132 . . . . 4.3300000000000001 110.301 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 32' ' ' THR . 38.1 t -78.76 -117.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.124 . . . . 2.6299999999999999 108.324 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.1 0 CA-C-O 117.076 -1.44 . . . . 6.6600000000000001 109.314 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.309 -0.626 . . . . 19.210000000000001 109.309 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 m -151.13 63.1 0.9 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.117 . . . . 17.210000000000001 110.401 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 p -94.27 53.37 1.71 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.122 . . . . 12.32 110.397 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -148.68 156.45 8.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 10.23 109.299 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.41 ' O ' ' O ' ' A' ' 72' ' ' ARG . 28.6 t -156.95 -97.03 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.476 1.11 . . . . 4.4100000000000001 110.032 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 0.6 OUTLIER 79.13 138.99 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 3.0699999999999998 110.311 179.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 148.88 35.75 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.552 1.817 . . . . 0.76000000000000001 110.978 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -76.07 150.35 83.21 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.109 . . . . 1.28 109.325 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.425 ' HD3' ' NE ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 -176.1 2.71 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.435 1.755 . . . . 1.5800000000000001 110.985 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.52 6.34 20.81 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.456 1.098 . . . . 1.8300000000000001 109.988 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 26' ' ' GLY . 2.0 p -96.42 20.09 11.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.533 1.146 . . . . 1.1399999999999999 108.327 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.576 HG21 ' NH1' ' A' ' 72' ' ' ARG . 70.0 t -149.47 121.83 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.517 1.135 . . . . 0.63 109.257 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.47 136.75 36.54 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.531 1.145 . . . . 1.0700000000000001 110.385 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.483 ' HA ' HD11 ' A' ' 70' ' ' LEU . 32.5 tp -89.98 105.53 17.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.545 1.153 . . . . 0.62 109.311 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.545 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -96.44 65.44 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.446 1.091 . . . . 1.27 110.958 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.674 ' OE1' ' HB3' ' A' ' 67' ' ' ALA . 17.4 tt0 -77.2 120.63 22.53 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 1.55 110.278 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.592 ' O ' ' CD2' ' A' ' 60' ' ' TYR . 6.4 p -87.77 -144.22 0.13 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.476 1.11 . . . . 1.3700000000000001 109.976 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.983 ' O ' HD12 ' A' ' 61' ' ' ILE . 32.4 p-90 -101.74 -54.76 2.66 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 108.012 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.637 ' HB3' ' CE3' ' A' ' 18' ' ' TRP . 2.8 ptt180 -107.67 14.75 25.32 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.489 1.118 . . . . 5.5099999999999998 110.299 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.616 ' CD1' ' HA2' ' A' ' 57' ' ' GLY . 0.2 OUTLIER -168.24 176.26 6.05 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.502 1.126 . . . . 5.4800000000000004 110.99 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.488 ' OG ' ' N ' ' A' ' 58' ' ' ASP . 5.1 p -143.61 159.73 41.93 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.496 1.122 . . . . 2.3300000000000001 110.022 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.545 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 3.2 mt-30 -141.26 135.92 31.12 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.49 1.118 . . . . 2.04 110.333 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.411 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -100.51 117.87 35.55 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.47 1.106 . . . . 0.60999999999999999 109.258 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 24' ' ' ASP . 2.2 t0 -98.22 113.7 25.72 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.502 1.126 . . . . 2.7200000000000002 109.272 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.608 ' HB2' HG12 ' A' ' 48' ' ' VAL . 58.5 t-20 -78.16 102.19 7.42 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.524 1.14 . . . . 0.63 109.249 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.7 3.52 81.38 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.452 1.095 . . . . 0.68000000000000005 110.985 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.13 -161.76 0.58 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.342 -0.985 . . . . 1.45 108.342 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.464 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -130.5 21.22 5.15 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 1.3400000000000001 109.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.428 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -153.31 147.55 25.75 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.469 1.106 . . . . 3.4300000000000002 110.357 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.8 m -59.47 127.87 34.21 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.492 1.12 . . . . 0.76000000000000001 110.392 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.518 HG21 HH12 ' A' ' 72' ' ' ARG . 15.9 m -141.87 154.06 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.513 1.133 . . . . 0.76000000000000001 109.329 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.688 HG21 ' SG ' ' A' ' 45' ' ' CYS . 1.8 m -101.73 141.19 34.97 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.524 1.14 . . . . 0.84999999999999998 110.425 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.411 HG21 ' CB ' ' A' ' 23' ' ' ALA . 1.8 m -129.93 170.69 18.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.445 1.091 . . . . 0.87 109.345 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.836 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 2.0 ptmt -160.64 89.46 0.82 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.504 1.128 . . . . 2.3700000000000001 109.289 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.91 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.8 OUTLIER -40.03 139.01 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.68999999999999995 109.35 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.906 HG22 ' HG2' ' A' ' 42' ' ' GLU . 75.0 t -118.03 117.29 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.531 1.144 . . . . 0.90000000000000002 109.282 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.583 ' CE2' ' HB3' ' A' ' 64' ' ' HIS . 78.4 m-85 -73.64 166.55 23.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 0.98999999999999999 110.984 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -5.59 33.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.505 1.128 . . . . 3.27 110.297 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.4 9.4 31.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.424 1.077 . . . . 2.6200000000000001 109.337 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.459 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 78.52 -1.25 2.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.479 1.112 . . . . 3.9300000000000002 109.293 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.2 p -83.2 167.63 17.54 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.539 1.149 . . . . 1.22 110.395 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.906 ' HG2' HG22 ' A' ' 36' ' ' VAL . 16.3 mt-10 -134.54 170.28 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.475 1.109 . . . . 2.1699999999999999 110.306 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.564 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -83.83 -115.57 0.63 Allowed Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.554 1.159 . . . . 2.0 111.017 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 43' ' ' GLY . 36.1 mt -148.44 147.58 29.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.501 0.766 . . . . 1.6100000000000001 109.299 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.688 ' SG ' HG21 ' A' ' 32' ' ' THR . 0.4 OUTLIER -47.2 120.33 3.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 1.112 . . . . 2.1299999999999999 108.285 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 1.116 ' CD2' HG12 ' A' ' 56' ' ' VAL . 6.1 m-85 -137.22 108.05 6.65 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.141 . . . . 1.8999999999999999 110.973 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.27 134.61 34.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.56999999999999995 109.255 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.809 HG22 ' HB ' ' A' ' 54' ' ' THR . 49.7 t -133.11 141.74 43.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.448 1.092 . . . . 0.33000000000000002 109.302 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.78 167.08 35.13 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.474 1.109 . . . . 0.53000000000000003 109.291 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -75.09 117.98 5.08 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.514 1.797 . . . . 0.87 110.954 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.6 28.76 18.25 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.492 1.12 . . . . 1.02 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.937 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -132.16 167.18 20.21 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.483 0.755 . . . . 2.4500000000000002 110.297 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.937 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -135.75 125.11 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 1.1200000000000001 109.284 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.809 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -125.78 137.23 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.124 . . . . 1.0 110.381 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 21' ' ' SER . 6.1 m -82.03 127.65 33.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.487 1.117 . . . . 1.9099999999999999 110.431 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 1.116 HG12 ' CD2' ' A' ' 46' ' ' TYR . 3.6 m -95.83 -51.97 10.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.522 1.138 . . . . 3.21 109.36 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.616 ' HA2' ' CD1' ' A' ' 20' ' ' TYR . . . 119.63 89.6 1.2 Allowed Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.517 1.136 . . . . 2.73 110.993 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.843 ' CG ' HG11 ' A' ' 35' ' ' VAL . 7.7 m-20 -170.24 126.32 0.79 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.508 0.77 . . . . 6.1799999999999997 109.354 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -131.76 162.27 23.8 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.494 1.121 . . . . 1.28 110.993 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.754 ' CE1' HG22 ' A' ' 61' ' ' ILE . 42.6 p90 -95.54 -6.94 39.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 0.762 . . . . 2.1299999999999999 111.023 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -96.98 12.09 4.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.484 1.115 . . . . 2.3999999999999999 109.269 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.503 ' N ' HD13 ' A' ' 61' ' ' ILE . . . -100.98 -173.7 29.02 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.472 1.107 . . . . 2.5800000000000001 110.949 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 p -90.89 -13.23 34.01 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 0.782 . . . . 4.4100000000000001 109.988 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.583 ' HB3' ' CE2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -79.43 1.49 25.29 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.511 1.132 . . . . 1.8 109.553 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 -142.88 22.83 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.479 1.112 . . . . 0.91000000000000003 110.978 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.579 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -116.45 165.08 13.63 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.507 0.769 . . . . 1.1599999999999999 109.575 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.674 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -83.01 121.6 27.22 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.561 1.163 . . . . 0.70999999999999996 109.321 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -75.74 -46.3 31.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.419 1.075 . . . . 4.5099999999999998 110.273 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 17.9 p90 178.92 161.74 0.72 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.494 1.121 . . . . 1.6100000000000001 111.002 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.91 ' CD2' HG23 ' A' ' 35' ' ' VAL . 17.4 mt -81.57 139.96 34.76 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.5 1.125 . . . . 1.3999999999999999 109.311 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.836 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -117.22 132.06 56.72 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.482 1.114 . . . . 0.62 109.319 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.576 ' NH1' HG21 ' A' ' 12' ' ' VAL . 3.9 mmt180 -63.5 144.87 56.62 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 5.5899999999999999 110.295 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.875 ' C ' HD23 ' A' ' 74' ' ' LEU . 50.9 t -126.4 143.86 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.547 1.155 . . . . 2.73 108.276 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.875 HD23 ' C ' ' A' ' 73' ' ' CYS . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 116.98 -1.486 . . . . 5.5999999999999996 109.29 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.407 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.317 -0.623 . . . . 13.619999999999999 109.317 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.413 ' O ' ' HB ' ' A' ' 3' ' ' THR . 2.2 p 43.52 -167.63 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 11.83 110.393 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 2' ' ' THR . 1.0 OUTLIER 179.55 55.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.127 . . . . 7.5499999999999998 110.384 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.447 ' O ' ' N ' ' A' ' 6' ' ' GLU . 7.0 t -82.06 78.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 8.3599999999999994 109.298 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m 46.98 -94.41 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.5 1.125 . . . . 3.0299999999999998 109.988 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 4' ' ' VAL . 1.2 mt-10 176.82 95.32 0.11 Allowed Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.529 1.143 . . . . 4.3399999999999999 110.278 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 134.73 18.24 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.524 1.802 . . . . 0.69999999999999996 111.024 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -58.37 166.75 2.04 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.496 1.122 . . . . 0.66000000000000003 109.322 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.632 ' HB3' HH21 ' A' ' 72' ' ' ARG . 18.3 Cg_endo -75.05 176.1 10.37 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.509 1.794 . . . . 0.77000000000000002 111.027 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 t -92.2 13.99 17.52 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.479 1.112 . . . . 2.5099999999999998 110.0 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 7.4 p -99.94 -18.23 17.18 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.5 1.125 . . . . 1.1599999999999999 108.29 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.834 HG12 HD12 ' A' ' 70' ' ' LEU . 1.4 t -97.77 117.9 43.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.548 1.155 . . . . 1.01 109.303 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.98 139.55 30.48 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.461 1.101 . . . . 1.25 110.39 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.87 HD13 HD21 ' A' ' 70' ' ' LEU . 10.3 tp -96.86 114.12 25.72 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 0.77000000000000002 109.283 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.8 OUTLIER -106.97 70.37 0.8 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 1.23 111.002 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.479 ' HA ' ' CB ' ' A' ' 21' ' ' SER . 2.8 tt0 -78.6 127.8 32.62 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 1.3999999999999999 110.317 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.596 ' O ' ' CE2' ' A' ' 60' ' ' TYR . 1.7 p -110.8 -151.63 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.52 1.138 . . . . 1.1100000000000001 109.985 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.671 ' HB2' HG21 ' A' ' 61' ' ' ILE . 28.1 p-90 -97.5 -47.49 5.64 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.524 1.14 . . . . 2.1899999999999999 108.026 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -37.55 55.29 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.128 . . . . 6.0800000000000001 110.278 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.547 ' C ' ' O ' ' A' ' 58' ' ' ASP . 6.4 p90 -166.22 -177.06 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.561 1.163 . . . . 7.2000000000000002 110.981 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 55' ' ' THR . 27.4 t -117.97 164.07 15.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 2.73 109.968 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 1.4 mt-30 -138.41 130.34 28.23 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 1.95 110.286 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -95.1 119.37 33.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 0.56999999999999995 109.301 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.626 ' HA ' HG23 ' A' ' 53' ' ' ILE . 2.1 t0 -97.68 115.59 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 2.25 109.26 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' A' ' 49' ' ' ALA . 38.3 t-20 -77.59 84.56 3.95 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.474 1.109 . . . . 0.66000000000000003 109.269 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.78 15.7 59.96 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.502 1.127 . . . . 0.67000000000000004 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.413 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -93.78 11.35 29.52 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.313 -0.995 . . . . 2.7599999999999998 108.313 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.5 32.45 0.09 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 2.02 109.321 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -158.01 133.72 9.07 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.555 1.159 . . . . 2.5899999999999999 110.321 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.42 HG23 ' HA ' ' A' ' 49' ' ' ALA . 3.0 m -50.23 119.33 3.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 0.89000000000000001 110.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 29' ' ' GLU . 27.4 m -145.82 163.68 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.456 1.098 . . . . 0.65000000000000002 109.304 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 47' ' ' ALA . 23.3 m -117.66 146.63 43.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.535 1.147 . . . . 0.66000000000000003 110.409 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.548 HG11 HG11 ' A' ' 12' ' ' VAL . 1.1 m -142.31 176.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.512 1.133 . . . . 0.57999999999999996 109.308 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.828 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 0.7 OUTLIER -160.19 103.56 1.45 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 2.4700000000000002 109.338 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 1.043 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -60.44 137.03 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.56000000000000005 109.341 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.885 HG22 ' HG2' ' A' ' 42' ' ' GLU . 13.0 t -116.64 124.23 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.85999999999999999 109.275 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.664 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 54.6 m-85 -76.26 166.71 23.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.466 1.104 . . . . 1.03 111.03 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 1.2 tt0 -61.42 -14.38 27.79 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 3.6200000000000001 110.29 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -84.87 7.93 19.23 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 1.97 109.265 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 t0 71.92 6.21 5.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.09 . . . . 3.9300000000000002 109.278 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.597 HG23 ' HB2' ' A' ' 39' ' ' ASP . 42.5 p -87.35 151.3 23.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 0.98999999999999999 110.409 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.885 ' HG2' HG22 ' A' ' 36' ' ' VAL . 4.6 mt-10 -118.52 141.42 48.58 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.512 1.132 . . . . 1.9399999999999999 110.338 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -65.89 -94.54 0.03 OUTLIER Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.475 1.109 . . . . 1.77 111.0 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 43' ' ' GLY . 50.8 mt -153.84 139.86 18.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.554 0.797 . . . . 1.3100000000000001 109.333 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 113.91 8.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.505 1.128 . . . . 1.6299999999999999 108.324 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.456 ' HD2' HG12 ' A' ' 56' ' ' VAL . 3.3 m-85 -124.03 138.47 54.44 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 1.138 . . . . 2.0600000000000001 111.019 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -96.09 115.6 27.68 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.506 1.129 . . . . 0.64000000000000001 109.318 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.968 HG22 ' HB ' ' A' ' 54' ' ' THR . 96.5 t -99.72 131.94 46.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 O-C-N 124.511 1.132 . . . . 0.51000000000000001 109.36 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -68.44 171.97 5.19 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 0.94999999999999996 109.334 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -74.99 111.54 3.35 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.5 1.789 . . . . 1.46 110.981 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.33 21.58 44.31 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.52 1.137 . . . . 0.68000000000000005 111.016 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.863 ' HG3' HG13 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -123.03 155.27 37.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.514 0.773 . . . . 2.8799999999999999 110.268 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.626 HG23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -122.36 129.49 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.529 1.143 . . . . 1.1799999999999999 109.328 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.968 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -126.92 138.6 53.32 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.459 1.099 . . . . 0.94999999999999996 110.425 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.534 ' CG2' ' CD1' ' A' ' 20' ' ' TYR . 2.0 m -78.41 139.48 38.75 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 1.3200000000000001 110.347 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 35' ' ' VAL . 3.6 m -113.51 -50.49 5.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.548 1.155 . . . . 2.2200000000000002 109.291 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.463 ' O ' HG11 ' A' ' 35' ' ' VAL . . . 132.53 123.14 2.41 Favored Glycine 0 CA--C 1.531 1.037 0 O-C-N 124.471 1.107 . . . . 2.8999999999999999 110.962 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.664 ' OD1' ' CE2' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 165.78 127.13 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.536 0.786 . . . . 7.0300000000000002 109.278 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -147.52 123.42 1.73 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.51 1.131 . . . . 1.3999999999999999 110.983 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.596 ' CE2' ' O ' ' A' ' 17' ' ' SER . 15.2 p90 -70.39 1.87 4.52 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.48 0.753 . . . . 2.6200000000000001 111.008 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.671 HG21 ' HB2' ' A' ' 18' ' ' TRP . 9.6 tt -110.94 38.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.461 1.101 . . . . 4.6399999999999997 109.316 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -139.45 -174.38 13.58 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.516 1.135 . . . . 2.3500000000000001 111.003 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.9 p -91.27 -6.24 53.52 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.531 0.783 . . . . 4.3200000000000003 110.001 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.612 ' HB3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -81.51 3.92 23.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.139 . . . . 2.0099999999999998 109.605 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.99 -148.36 37.82 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.505 1.128 . . . . 1.0900000000000001 111.002 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.574 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -120.53 135.73 54.99 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.482 0.754 . . . . 1.45 109.611 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.637 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . . . -36.73 134.59 0.48 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 0.89000000000000001 109.329 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.563 ' CD ' ' HA ' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -91.49 -47.24 7.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.473 1.108 . . . . 4.7800000000000002 110.269 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.582 ' CD1' ' HB ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -178.11 173.95 1.42 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 2.25 110.993 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 1.043 ' CD2' HG23 ' A' ' 35' ' ' VAL . 4.5 mt -96.85 144.78 26.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.486 1.117 . . . . 1.5 109.249 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.828 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -125.94 129.58 49.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.494 1.121 . . . . 0.47999999999999998 109.289 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.632 HH21 ' HB3' ' A' ' 9' ' ' PRO . 4.5 ptp180 -85.57 141.74 29.63 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.53 1.144 . . . . 3.79 110.316 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -4.37 50.45 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 2.1000000000000001 108.305 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.429 ' HA ' HD22 ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.0 -1.476 . . . . 5.4199999999999999 109.314 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.472 ' O ' HG23 ' A' ' 2' ' ' THR . 4.2 p-10 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.317 -0.623 . . . . 12.470000000000001 109.317 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 1' ' ' ASP . 2.4 p -153.52 -97.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.489 1.118 . . . . 12.109999999999999 110.403 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.577 HG22 ' H ' ' A' ' 4' ' ' VAL . 2.6 m -116.78 -152.52 0.51 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.498 1.124 . . . . 8.1999999999999993 110.41 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.577 ' H ' HG22 ' A' ' 3' ' ' THR . 13.6 p -113.81 38.07 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.459 1.099 . . . . 6.7199999999999998 109.308 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 m -110.23 -174.83 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 2.9900000000000002 110.011 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 1.8 tt0 -140.94 132.45 13.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.536 1.147 . . . . 3.0 110.238 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 138.37 22.88 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.512 1.796 . . . . 0.71999999999999997 110.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.67 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.68 170.09 0.31 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 0.67000000000000004 109.309 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.67 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.03 167.46 26.98 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.474 1.776 . . . . 0.94999999999999996 110.977 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 45.5 p -85.06 7.67 20.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.517 1.136 . . . . 2.6000000000000001 110.008 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 6.1 p -114.76 29.79 7.78 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 1.01 108.255 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 33' ' ' VAL . 89.1 t -143.25 109.66 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.536 1.148 . . . . 0.63 109.299 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.43 153.79 29.43 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 0.91000000000000003 110.436 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.525 HD13 HG23 ' A' ' 35' ' ' VAL . 15.1 tp -105.23 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.443 1.09 . . . . 0.54000000000000004 109.327 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -88.64 57.27 4.11 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.541 1.15 . . . . 1.71 110.946 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.438 ' HA ' ' HA ' ' A' ' 21' ' ' SER . 3.8 tt0 -76.26 100.71 5.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 1.3999999999999999 110.3 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.627 ' O ' ' CE1' ' A' ' 60' ' ' TYR . 1.4 p -77.79 -150.41 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.445 1.091 . . . . 1.0900000000000001 109.984 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 1.101 ' CA ' HD11 ' A' ' 61' ' ' ILE . 34.6 p-90 -98.45 -65.18 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.045 -1.094 . . . . 2.2000000000000002 108.045 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.594 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -93.1 16.68 12.33 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.486 1.116 . . . . 5.8600000000000003 110.329 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 1.082 ' CE2' HG21 ' A' ' 55' ' ' THR . 0.0 OUTLIER -168.71 161.62 11.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 5.0099999999999998 110.984 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.486 ' OG ' ' C ' ' A' ' 57' ' ' GLY . 65.1 p -143.28 135.6 27.16 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 110.027 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.609 ' OE1' HG23 ' A' ' 55' ' ' THR . 0.0 OUTLIER -135.25 177.87 7.47 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.507 1.129 . . . . 2.4500000000000002 110.314 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.23 133.72 39.28 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.524 1.14 . . . . 0.65000000000000002 109.266 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG1' ' A' ' 53' ' ' ILE . 39.8 t0 -103.29 130.44 50.56 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 2.29 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.638 ' HB2' HG12 ' A' ' 48' ' ' VAL . 23.7 t-20 -84.4 96.87 9.21 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.444 1.09 . . . . 0.62 109.285 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -86.47 2.01 87.36 Favored Glycine 0 CA--C 1.529 0.968 0 O-C-N 124.53 1.144 . . . . 0.64000000000000001 111.023 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.465 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -88.94 -157.76 0.46 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.272 -1.01 . . . . 1.6200000000000001 108.272 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.414 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -131.1 16.29 5.1 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 1.1499999999999999 109.315 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -144.14 152.15 40.53 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.562 1.164 . . . . 2.9900000000000002 110.285 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 48' ' ' VAL . 90.7 m -71.48 130.8 42.19 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.528 1.143 . . . . 1.0 110.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.8 m -141.46 164.0 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.467 1.105 . . . . 0.59999999999999998 109.294 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 ' SG ' ' A' ' 73' ' ' CYS . 74.9 m -113.25 141.44 46.99 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.67000000000000004 110.415 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 12' ' ' VAL . 1.2 m -137.74 174.17 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.468 1.105 . . . . 0.56999999999999995 109.282 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.645 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 5.3 pttt -155.33 105.21 2.47 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 1.9399999999999999 109.316 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.595 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.27 115.65 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.516 1.135 . . . . 0.78000000000000003 109.248 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.876 HG22 ' HG2' ' A' ' 42' ' ' GLU . 99.2 t -98.85 119.3 46.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.56000000000000005 109.277 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.623 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 68.7 m-85 -78.61 170.05 17.26 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 1.22 110.998 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG3' ' CG ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -68.05 -12.45 60.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.527 1.142 . . . . 4.46 110.297 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.3 16.62 7.13 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.504 1.128 . . . . 1.8 109.285 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.2 t0 65.22 10.68 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 3.9199999999999999 109.306 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.575 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 0.1 OUTLIER -83.99 155.07 22.95 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.547 1.154 . . . . 1.23 110.381 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.876 ' HG2' HG22 ' A' ' 36' ' ' VAL . 13.0 mt-10 -133.33 127.07 32.75 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.485 1.116 . . . . 2.3300000000000001 110.273 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.721 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -52.29 -105.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.496 1.123 . . . . 1.79 110.989 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.721 HD23 ' O ' ' A' ' 43' ' ' GLY . 49.9 mt -153.23 138.06 17.09 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.442 0.731 . . . . 1.4199999999999999 109.302 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.429 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -55.05 112.08 0.98 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.529 1.143 . . . . 1.3899999999999999 108.282 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.598 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 35.2 m-85 -121.74 123.71 42.48 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.525 1.141 . . . . 1.52 110.983 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.45 120.18 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.53 1.144 . . . . 0.46000000000000002 109.3 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.638 HG12 ' HB2' ' A' ' 25' ' ' ASN . 53.4 t -115.9 142.7 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.495 1.122 . . . . 0.40000000000000002 109.331 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.654 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -86.31 169.47 15.18 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.554 1.159 . . . . 0.51000000000000001 109.352 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.654 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.0 104.84 1.97 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.517 1.798 . . . . 0.75 111.02 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.86 34.78 2.93 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.494 1.121 . . . . 0.76000000000000001 111.022 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -152.33 158.08 42.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.461 0.741 . . . . 2.3399999999999999 110.276 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' ' HA ' ' A' ' 24' ' ' ASP . 8.0 mt -126.21 153.33 34.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.478 1.111 . . . . 2.02 109.294 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.536 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.5 OUTLIER -153.65 142.94 21.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.459 1.099 . . . . 0.85999999999999999 110.401 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' THR . . . . . 1.082 HG21 ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -62.84 142.89 58.04 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 1.26 110.391 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.52 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 4.4 m -122.92 -7.28 8.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 2.0499999999999998 109.29 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.486 ' C ' ' OG ' ' A' ' 21' ' ' SER . . . 159.48 -156.17 27.3 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.485 1.115 . . . . 2.3799999999999999 111.027 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.452 ' HA ' ' HA ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -91.65 179.0 5.76 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 0.773 . . . . 6.21 109.304 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.471 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -89.45 -145.43 12.25 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.542 1.151 . . . . 1.4299999999999999 110.959 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.627 ' CE1' ' O ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -98.46 -1.2 41.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.491 0.76 . . . . 2.7200000000000002 110.968 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 1.101 HD11 ' CA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -107.32 37.13 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.472 1.107 . . . . 4.4000000000000004 109.341 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -125.75 -164.23 11.76 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.454 1.097 . . . . 3.1299999999999999 110.987 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.9 m -91.51 -5.0 54.88 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.526 0.78 . . . . 3.7200000000000002 110.019 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.623 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 6.1 m-70 -100.01 39.14 1.36 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.118 . . . . 2.2400000000000002 109.604 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 45.84 -137.61 7.35 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.49 1.118 . . . . 0.90000000000000002 111.01 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.529 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.8 OUTLIER -121.27 123.49 42.33 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.522 0.778 . . . . 1.1200000000000001 109.56 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.498 ' HB1' HG22 ' A' ' 35' ' ' VAL . . . -43.06 117.76 1.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 0.56000000000000005 109.306 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -76.62 -40.9 47.9 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 4.4299999999999997 110.326 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 12.5 p90 -178.24 -170.21 0.22 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.541 1.15 . . . . 1.02 110.959 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.595 HD23 ' HA ' ' A' ' 35' ' ' VAL . 51.8 mt -114.64 134.5 55.02 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.516 1.135 . . . . 1.1599999999999999 109.329 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.645 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -113.92 130.0 56.55 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.478 1.111 . . . . 0.53000000000000003 109.297 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.516 ' HD3' HD11 ' A' ' 74' ' ' LEU . 3.3 ptp180 -86.49 138.69 31.54 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 4.6600000000000001 110.276 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.756 ' C ' HD13 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -112.77 113.34 25.4 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.486 1.116 . . . . 2.4199999999999999 108.295 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.786 HD13 ' N ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 116.97 -1.491 . . . . 5.29 109.275 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.313 -0.625 . . . . 14.81 109.313 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.604 HG23 ' H ' ' A' ' 3' ' ' THR . 0.4 OUTLIER -175.91 -60.62 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.519 1.137 . . . . 10.800000000000001 110.366 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' THR . . . . . 0.604 ' H ' HG23 ' A' ' 2' ' ' THR . 11.0 t 43.76 -163.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.464 1.103 . . . . 9.2300000000000004 110.413 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.421 ' N ' ' OG1' ' A' ' 3' ' ' THR . 7.8 m -130.46 135.11 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.505 1.128 . . . . 8.8599999999999994 109.28 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.419 ' CB ' ' OH ' ' A' ' 69' ' ' TYR . 1.9 m 53.7 -146.41 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.484 1.115 . . . . 3.7999999999999998 110.013 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.56 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 1.3 tt0 -149.54 106.5 3.3 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.45 1.094 . . . . 3.73 110.267 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 142.93 28.56 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.538 1.81 . . . . 0.70999999999999996 111.031 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.884 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -74.43 179.81 1.2 Allowed Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.482 1.114 . . . . 0.75 109.296 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.884 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.4 Cg_endo -74.94 165.19 31.88 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.545 1.813 . . . . 0.94999999999999996 111.018 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.7 m -90.47 16.26 9.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.554 1.159 . . . . 2.3100000000000001 110.006 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.455 ' O ' ' N ' ' A' ' 26' ' ' GLY . 26.6 p -108.43 12.28 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.493 1.121 . . . . 0.90000000000000002 108.293 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 33' ' ' VAL . 75.4 t -128.07 117.57 46.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 0.68999999999999995 109.288 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.34 145.45 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.96999999999999997 110.386 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.572 HD13 HD21 ' A' ' 70' ' ' LEU . 43.9 tp -101.63 105.46 16.4 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 0.58999999999999997 109.326 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.547 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -98.08 65.91 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 1.3600000000000001 110.999 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.466 HE21 ' HB3' ' A' ' 16' ' ' GLN . 0.3 OUTLIER -79.5 118.27 21.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.449 1.093 . . . . 1.3300000000000001 110.312 179.975 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -100.84 -157.55 0.62 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.505 1.128 . . . . 1.22 110.007 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.876 ' HB2' HG23 ' A' ' 61' ' ' ILE . 62.9 p-90 -96.06 -45.35 6.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.522 1.139 . . . . 2.04 107.991 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 17.9 ptt180 -77.53 -37.02 51.78 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.45 1.094 . . . . 7.1500000000000004 110.31 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.633 ' CD2' ' HA2' ' A' ' 57' ' ' GLY . 0.3 OUTLIER -164.6 173.7 11.67 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 7.0199999999999996 111.01 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.51 ' O ' ' CG2' ' A' ' 55' ' ' THR . 54.4 p -116.75 158.12 24.38 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 2.1699999999999999 109.992 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.798 ' HG2' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -142.76 134.44 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.475 1.109 . . . . 3.04 110.315 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.463 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -98.01 128.68 44.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 0.44 109.282 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -106.22 120.4 41.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.547 1.155 . . . . 2.48 109.32 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.639 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.6 t-20 -77.81 89.98 4.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.549 1.155 . . . . 0.52000000000000002 109.286 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -83.98 8.16 67.8 Favored Glycine 0 CA--C 1.531 1.036 0 O-C-N 124.527 1.142 . . . . 0.76000000000000001 110.989 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.65 -156.36 0.24 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.314 -0.995 . . . . 1.8 108.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.35 18.84 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.51 1.131 . . . . 1.04 109.279 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.74 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.2 mt-10 -155.85 135.05 12.19 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.119 . . . . 1.98 110.241 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.5 m -41.67 124.83 2.62 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 0.78000000000000003 110.406 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.74 HG13 ' O ' ' A' ' 29' ' ' GLU . 17.5 m -139.35 154.8 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 0.93000000000000005 109.292 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.527 HG22 ' HB2' ' A' ' 73' ' ' CYS . 30.7 m -108.09 146.18 33.0 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 0.88 110.378 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -138.16 172.01 14.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.54 1.15 . . . . 0.79000000000000004 109.278 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HD3' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -162.01 101.11 1.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.468 1.105 . . . . 2.7599999999999998 109.279 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.802 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -59.98 133.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.457 1.098 . . . . 0.68000000000000005 109.344 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 68' ' ' ARG . 90.6 t -113.22 124.68 70.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 0.68000000000000005 109.296 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.638 ' CZ ' ' OD1' ' A' ' 58' ' ' ASP . 11.7 m-85 -75.83 166.35 23.65 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.446 1.092 . . . . 1.6100000000000001 111.025 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.408 ' O ' ' OE1' ' A' ' 38' ' ' GLU . 1.7 tm-20 -72.26 -8.01 52.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.143 . . . . 3.4199999999999999 110.308 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -95.69 10.13 37.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.524 1.14 . . . . 2.0299999999999998 109.251 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 80.78 8.47 1.21 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 4.9800000000000004 109.294 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -79.77 166.71 21.48 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.514 1.134 . . . . 1.96 110.429 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.409 ' CD ' HG22 ' A' ' 36' ' ' VAL . 2.4 mt-10 -131.93 153.11 50.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.516 1.135 . . . . 3.25 110.308 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 35' ' ' VAL . . . -99.38 33.31 6.28 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.463 1.102 . . . . 3.3900000000000001 110.966 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 46' ' ' TYR . 0.5 OUTLIER 60.35 151.8 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.51 0.77 . . . . 2.52 109.327 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 73' ' ' CYS . 0.0 OUTLIER -85.26 141.54 30.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.521 1.138 . . . . 2.4500000000000002 108.253 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.773 ' HD2' HG12 ' A' ' 56' ' ' VAL . 27.7 m-85 -150.29 135.71 18.07 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.49 1.118 . . . . 2.4199999999999999 110.995 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.46 141.73 28.41 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 0.77000000000000002 109.277 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' HB ' ' A' ' 54' ' ' THR . 44.2 t -137.15 134.06 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.134 . . . . 0.63 109.321 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -71.83 166.44 40.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 0.63 109.325 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.02 113.96 3.91 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.503 1.791 . . . . 0.72999999999999998 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.72 8.57 54.25 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.512 1.133 . . . . 0.79000000000000004 111.024 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.12 161.85 17.83 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.539 0.788 . . . . 2.4700000000000002 110.324 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.798 HG22 ' HG2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -128.7 148.32 33.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.75 109.299 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.657 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -150.38 136.29 18.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 0.92000000000000004 110.399 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.51 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.4 m -74.75 138.4 42.68 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.523 1.139 . . . . 1.1000000000000001 110.43 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.773 HG12 ' HD2' ' A' ' 46' ' ' TYR . 10.5 m -110.45 -51.28 6.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.501 1.125 . . . . 2.2400000000000002 109.323 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.633 ' HA2' ' CD2' ' A' ' 20' ' ' TYR . . . 133.09 117.4 1.82 Allowed Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.513 1.133 . . . . 3.0800000000000001 110.993 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.638 ' OD1' ' CZ ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 162.6 130.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.528 0.781 . . . . 6.9400000000000004 109.276 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -144.75 116.38 0.93 Allowed Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.49 1.119 . . . . 1.3899999999999999 110.942 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.726 ' O ' ' CG ' ' A' ' 60' ' ' TYR . 0.5 OUTLIER -78.99 50.38 1.02 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.474 0.749 . . . . 2.0299999999999998 111.03 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.876 HG23 ' HB2' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -84.54 -18.06 9.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 2.9399999999999999 109.34 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.79 10.54 20.97 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 124.512 1.133 . . . . 3.4399999999999999 110.938 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -90.54 -77.76 0.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 0.771 . . . . 3.1800000000000002 110.001 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.45 ' ND1' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -89.72 25.91 1.91 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.465 1.103 . . . . 3.0099999999999998 109.595 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 76.14 -144.45 30.91 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.483 1.114 . . . . 1.3300000000000001 110.95 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.633 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -131.79 135.43 46.76 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.503 0.766 . . . . 1.1499999999999999 109.567 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.599 ' HB2' ' OD2' ' A' ' 58' ' ' ASP . . . -38.82 128.95 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.547 1.154 . . . . 0.94999999999999996 109.277 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' A' ' 36' ' ' VAL . 2.1 ttt180 -77.34 -49.27 15.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 5.9400000000000004 110.333 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.419 ' OH ' ' CB ' ' A' ' 5' ' ' SER . 13.0 p90 -176.01 173.48 2.25 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.535 1.147 . . . . 1.3300000000000001 111.031 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.802 ' CD2' HG23 ' A' ' 35' ' ' VAL . 7.7 mt -96.24 135.98 37.33 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.499 1.124 . . . . 0.95999999999999996 109.277 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 6' ' ' GLU . . . -117.18 163.37 16.39 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.461 1.101 . . . . 1.1799999999999999 109.317 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HG3' ' CG ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -114.81 136.85 52.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.522 1.139 . . . . 3.1499999999999999 110.249 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 45' ' ' CYS . 1.4 t -78.41 -17.93 55.71 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.497 1.123 . . . . 1.9399999999999999 108.263 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HB2' ' NH1' ' A' ' 72' ' ' ARG . 4.6 mt . . . . . 0 C--O 1.25 1.105 0 CA-C-O 116.95 -1.5 . . . . 5.7999999999999998 109.325 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.318 -0.623 . . . . 12.24 109.318 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 t -110.04 -38.16 5.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.479 1.112 . . . . 9.8699999999999992 110.413 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.5 m -144.24 108.55 4.81 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.513 1.133 . . . . 7.4900000000000002 110.423 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.658 HG13 ' N ' ' A' ' 5' ' ' SER . 1.1 p -68.21 -161.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.512 1.133 . . . . 6.9800000000000004 109.319 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.658 ' N ' HG13 ' A' ' 4' ' ' VAL . 0.2 OUTLIER 84.07 -73.61 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 3.54 110.045 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.678 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 0.1 OUTLIER 82.71 120.41 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.5 1.125 . . . . 3.3399999999999999 110.332 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 139.52 24.41 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.531 1.806 . . . . 0.56000000000000005 111.013 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.493 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.83 164.07 1.0 Allowed Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.12 . . . . 0.56999999999999995 109.34 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.1 Cg_endo -75.02 172.13 16.97 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.424 1.749 . . . . 0.72999999999999998 111.009 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 95.6 p -83.33 8.49 13.42 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 2.3399999999999999 110.034 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 15.7 p -110.14 29.15 7.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.51 1.131 . . . . 1.0 108.315 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 83.1 t -145.18 114.94 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 0.60999999999999999 109.326 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.6 142.62 28.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.53 1.144 . . . . 1.3600000000000001 110.362 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.686 HD21 ' HB3' ' A' ' 67' ' ' ALA . 20.1 tp -85.47 157.95 20.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.52 1.138 . . . . 1.1200000000000001 109.29 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -148.97 76.06 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.6299999999999999 111.006 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.409 ' HA ' ' OG ' ' A' ' 21' ' ' SER . 28.6 tt0 -79.93 141.5 35.99 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.475 1.11 . . . . 1.8999999999999999 110.296 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' SER . . . . . 0.473 ' O ' ' CD1' ' A' ' 60' ' ' TYR . 81.4 p -115.35 -128.24 0.29 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 1.78 109.984 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.67 ' HA ' ' CD1' ' A' ' 60' ' ' TYR . 41.2 p-90 -94.07 -68.4 0.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.561 1.163 . . . . 5.3200000000000003 108.047 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.646 ' HB2' ' CE3' ' A' ' 18' ' ' TRP . 2.1 ttp180 -118.12 37.06 4.11 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.409 1.068 . . . . 9.1500000000000004 110.289 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -177.67 159.25 1.43 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 6.2400000000000002 110.977 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.597 ' CB ' ' HB2' ' A' ' 58' ' ' ASP . 40.4 m -131.77 166.25 21.96 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.464 1.102 . . . . 2.02 109.995 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.457 ' N ' ' O ' ' A' ' 15' ' ' TYR . 1.7 tt0 -138.85 140.83 38.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.466 1.104 . . . . 2.3199999999999998 110.311 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.07 123.26 47.5 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.534 1.147 . . . . 0.52000000000000002 109.339 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.604 ' HA ' HG23 ' A' ' 53' ' ' ILE . 1.7 t0 -100.17 120.28 39.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.499 1.124 . . . . 2.0800000000000001 109.303 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.705 ' HB2' HG12 ' A' ' 48' ' ' VAL . 20.2 t-20 -78.7 101.39 7.5 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.48 1.113 . . . . 0.79000000000000004 109.361 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.24 -0.52 76.86 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.493 1.121 . . . . 0.69999999999999996 110.991 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' CYS . . . . . 0.519 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -85.32 -158.66 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.295 -1.002 . . . . 1.5900000000000001 108.295 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.462 ' HA ' ' CB ' ' A' ' 50' ' ' PRO . . . -133.4 28.47 4.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 1.0900000000000001 109.264 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -154.04 150.35 28.14 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.424 1.077 . . . . 3.25 110.309 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.496 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.2 m -73.76 127.66 33.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.435 1.085 . . . . 0.93000000000000005 110.38 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.2 m -142.25 166.61 16.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 0.81999999999999995 109.301 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.829 HG22 ' SG ' ' A' ' 45' ' ' CYS . 23.3 m -116.12 138.65 51.07 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.114 . . . . 0.91000000000000003 110.372 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.704 HG23 HD22 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -141.97 172.5 9.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.521 1.138 . . . . 0.90000000000000002 109.267 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.753 ' HE2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -148.19 118.06 7.15 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.555 1.159 . . . . 2.4300000000000002 109.288 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.819 HG11 ' OD2' ' A' ' 58' ' ' ASP . 0.4 OUTLIER -58.77 146.9 8.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.527 1.142 . . . . 0.73999999999999999 109.308 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 42' ' ' GLU . 73.4 t -126.79 123.22 62.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.558 1.161 . . . . 0.66000000000000003 109.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 89.5 m-85 -74.29 163.0 28.34 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.467 1.105 . . . . 1.55 111.014 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.2 OUTLIER -62.52 -12.07 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.512 1.132 . . . . 3.5699999999999998 110.343 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.62 5.5 35.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.484 1.115 . . . . 1.8700000000000001 109.31 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.9 OUTLIER 80.08 -2.91 1.99 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.453 1.096 . . . . 4.21 109.275 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' THR . . . . . 0.404 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.2 p -80.11 172.81 13.28 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.516 1.135 . . . . 1.3 110.396 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' GLU . . . . . 0.634 ' HG2' HG22 ' A' ' 36' ' ' VAL . 6.8 mt-10 -140.94 159.73 41.59 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.424 1.078 . . . . 1.8600000000000001 110.303 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -89.79 -99.66 1.09 Allowed Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.563 1.164 . . . . 1.9099999999999999 110.972 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.579 HD23 ' O ' ' A' ' 43' ' ' GLY . 54.6 mt -141.24 145.1 35.15 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.513 0.772 . . . . 1.6200000000000001 109.324 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' CYS . . . . . 0.829 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.7 OUTLIER -81.05 131.54 35.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.544 1.153 . . . . 1.8 108.302 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.751 ' HB2' HG12 ' A' ' 56' ' ' VAL . 28.8 m-85 -138.92 145.34 39.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.102 . . . . 2.02 110.969 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.47 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -94.15 129.83 40.58 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.508 1.13 . . . . 0.56000000000000005 109.278 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.861 HG22 ' HB ' ' A' ' 54' ' ' THR . 50.9 t -124.79 144.93 33.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.489 1.118 . . . . 0.38 109.291 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.572 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -89.75 166.76 19.45 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.541 1.151 . . . . 0.72999999999999998 109.315 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.572 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 123.18 7.7 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.504 1.792 . . . . 1.05 111.013 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.01 21.74 41.16 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 124.527 1.142 . . . . 1.1899999999999999 110.994 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.943 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -134.2 169.81 16.62 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.518 0.775 . . . . 2.8900000000000001 110.305 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.943 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -136.74 138.13 46.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 1.1000000000000001 109.268 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.861 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -138.11 140.91 40.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.478 1.111 . . . . 0.94999999999999996 110.438 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' THR . . . . . 0.479 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.5 m -84.9 127.31 34.1 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.468 1.105 . . . . 1.49 110.387 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.751 HG12 ' HB2' ' A' ' 46' ' ' TYR . 3.9 m -101.75 -42.89 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.477 1.11 . . . . 2.6200000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.551 ' O ' ' CB ' ' A' ' 58' ' ' ASP . . . 138.79 159.4 8.03 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.553 1.158 . . . . 2.46 110.985 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.819 ' OD2' HG11 ' A' ' 35' ' ' VAL . 2.4 m-20 152.03 -171.2 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.46 0.741 . . . . 6.4900000000000002 109.291 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.553 ' HA2' ' O ' ' A' ' 18' ' ' TRP . . . 174.73 118.46 0.52 Allowed Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.495 1.122 . . . . 1.9099999999999999 111.008 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.67 ' CD1' ' HA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -101.9 11.75 38.08 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.507 0.769 . . . . 3.5299999999999998 111.057 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ILE . . . . . 0.675 ' H ' HD13 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -72.5 -5.19 5.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.5 1.125 . . . . 3.0899999999999999 109.265 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 118.18 2.09 16.03 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.505 1.128 . . . . 2.73 111.016 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.8 m -60.14 -101.2 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 0.77 . . . . 3.4100000000000001 110.044 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.571 ' HB3' ' CD2' ' A' ' 37' ' ' TYR . 0.3 OUTLIER -91.92 27.91 1.98 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.566 1.166 . . . . 3.5 109.631 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' GLY . . . 84.31 -140.96 19.51 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.507 1.129 . . . . 1.3400000000000001 111.009 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.503 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -126.68 131.61 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 0.735 . . . . 2.0600000000000001 109.634 179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.686 ' HB3' HD21 ' A' ' 14' ' ' LEU . . . -38.47 119.78 0.85 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 0.73999999999999999 109.284 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 38' ' ' GLU . 7.6 ttp85 -78.69 -44.27 24.0 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 5.1799999999999997 110.308 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 69' ' ' TYR . 7.8 p90 -176.43 167.88 2.76 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.517 1.135 . . . . 1.0 111.0 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.769 HD23 ' HA ' ' A' ' 35' ' ' VAL . 14.4 mt -101.2 147.29 26.44 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.533 1.146 . . . . 1.6100000000000001 109.329 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.753 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . . . -131.33 149.04 52.72 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.524 1.14 . . . . 0.56999999999999995 109.267 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -88.72 150.73 22.83 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 1.108 . . . . 3.71 110.277 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.5 m -115.06 137.03 52.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 2.3100000000000001 108.301 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.899 HD12 ' OXT' ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.113 0 CA-C-O 117.0 -1.476 . . . . 5.1500000000000004 109.294 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.467 ' CG ' ' HD2' ' A' ' 7' ' ' PRO . 4.7 tt0 . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 110.322 -0.251 . . . . 3.7400000000000002 110.322 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 6' ' ' GLU . 18.3 Cg_endo -74.99 144.8 30.71 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.507 1.793 . . . . 0.83999999999999997 111.008 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -61.18 173.21 0.75 Allowed Pre-proline 0 C--N 1.326 -0.428 0 O-C-N 124.509 1.131 . . . . 0.66000000000000003 109.325 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -74.99 172.13 16.96 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.526 1.803 . . . . 0.93999999999999995 111.004 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.51 11.16 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 2.1899999999999999 110.037 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 26' ' ' GLY . 7.9 p -108.29 20.75 18.25 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.533 1.146 . . . . 0.97999999999999998 108.261 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.726 HG13 ' O ' ' A' ' 24' ' ' ASP . 43.9 t -138.28 131.46 40.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.565 1.166 . . . . 0.92000000000000004 109.27 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' LEU . 1.1 m -97.92 167.02 11.17 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.498 1.124 . . . . 2.23 110.389 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 1.013 HD13 HD21 ' A' ' 70' ' ' LEU . 14.7 tp -123.76 130.91 53.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.69999999999999996 109.267 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -115.67 70.14 0.74 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 1.125 . . . . 1.29 110.985 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.647 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.9 tt0 -91.92 102.19 14.76 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.493 1.121 . . . . 1.3999999999999999 110.284 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' CA ' ' A' ' 59' ' ' GLY . 10.5 p -106.68 -152.92 0.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 1.9199999999999999 110.007 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.613 ' O ' HD12 ' A' ' 61' ' ' ILE . 55.7 p-90 -93.35 -27.54 16.71 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.496 1.122 . . . . 2.6299999999999999 107.981 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -77.2 -61.64 1.92 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 6.1900000000000004 110.337 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 2.6 p90 -159.25 177.09 11.4 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.125 . . . . 8.1199999999999992 110.998 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.498 ' O ' HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -106.77 132.97 52.13 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.544 1.153 . . . . 2.1400000000000001 110.036 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.954 ' NE2' HG22 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -120.65 142.9 49.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 2.6000000000000001 110.286 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.741 ' CB ' HG11 ' A' ' 56' ' ' VAL . . . -112.7 123.75 51.0 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.509 1.131 . . . . 0.59999999999999998 109.259 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.726 ' O ' HG13 ' A' ' 12' ' ' VAL . 39.6 t0 -107.47 126.15 52.15 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.469 1.106 . . . . 2.3100000000000001 109.332 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.534 ' CB ' HG12 ' A' ' 48' ' ' VAL . 56.5 t-20 -94.04 89.67 6.12 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.543 1.152 . . . . 0.67000000000000004 109.309 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -81.27 8.34 58.35 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.525 1.14 . . . . 1.02 110.981 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -179.99 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.301 -1.0 . . . . 1.8 108.301 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.444 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -115.49 21.25 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 1.1299999999999999 109.294 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.474 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.5 mt-10 -154.02 137.99 16.34 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.464 1.102 . . . . 2.1299999999999999 110.301 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.417 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.8 m -51.72 130.3 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.533 1.146 . . . . 0.92000000000000004 110.455 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 29' ' ' GLU . 20.9 m -140.29 153.65 22.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 0.68000000000000005 109.287 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.82 HG22 ' SG ' ' A' ' 45' ' ' CYS . 54.8 m -113.15 133.13 55.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.56 1.163 . . . . 0.81000000000000005 110.397 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 1.4 m -135.24 179.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.72999999999999998 109.275 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 13.6 pttm -159.7 108.88 1.81 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.544 1.152 . . . . 2.5699999999999998 109.253 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 1.048 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.59 114.59 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 0.52000000000000002 109.311 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.785 HG22 ' HG2' ' A' ' 42' ' ' GLU . 19.4 t -97.33 121.18 47.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 0.73999999999999999 109.289 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -78.89 178.62 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.489 1.118 . . . . 0.93000000000000005 111.021 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 0.4 OUTLIER -84.61 -9.77 57.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.487 1.117 . . . . 3.2000000000000002 110.273 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.489 ' HB2' ' CG2' ' A' ' 41' ' ' THR . 0.0 OUTLIER -81.59 0.93 36.12 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.546 1.154 . . . . 2.0800000000000001 109.299 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.488 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 81.52 31.0 0.13 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.15 . . . . 3.6800000000000002 109.317 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.489 ' CG2' ' HB2' ' A' ' 39' ' ' ASP . 0.2 OUTLIER -124.44 174.28 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 2.04 110.392 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.785 ' HG2' HG22 ' A' ' 36' ' ' VAL . 1.7 mp0 -135.84 151.24 49.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.511 1.132 . . . . 2.6800000000000002 110.3 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.601 ' O ' ' CE2' ' A' ' 46' ' ' TYR . . . -87.78 46.51 3.45 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 124.55 1.156 . . . . 3.2400000000000002 111.019 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.98 154.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 0.754 . . . . 2.23 109.301 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.82 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.8 OUTLIER -91.1 123.07 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 1.99 108.298 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CE2' ' O ' ' A' ' 43' ' ' GLY . 25.8 m-85 -124.93 137.59 54.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.48 1.112 . . . . 2.3900000000000001 110.971 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.85 130.21 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.117 . . . . 0.70999999999999996 109.277 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.534 HG12 ' CB ' ' A' ' 25' ' ' ASN . 40.6 t -126.81 138.02 56.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.56999999999999995 109.285 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.733 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -81.07 172.9 8.65 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 0.90000000000000002 109.291 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.733 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.08 99.32 1.24 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.522 1.801 . . . . 0.79000000000000004 110.979 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.3 30.13 3.22 Favored Glycine 0 CA--C 1.53 1.001 0 O-C-N 124.496 1.122 . . . . 1.1499999999999999 110.982 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.973 ' O ' HD13 ' A' ' 53' ' ' ILE . 34.4 tt0 -125.49 153.29 43.78 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.465 0.744 . . . . 3.4199999999999999 110.327 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.973 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -139.33 120.77 15.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.51 1.131 . . . . 1.3400000000000001 109.333 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.513 ' N ' HE22 ' A' ' 22' ' ' GLN . 0.7 OUTLIER -143.04 154.66 44.2 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.094 . . . . 1.52 110.415 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -61.88 146.68 49.05 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.526 1.142 . . . . 1.2 110.398 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.741 HG11 ' CB ' ' A' ' 23' ' ' ALA . 29.2 m -139.33 11.12 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.52 1.137 . . . . 2.5699999999999998 109.293 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 170.38 -169.58 42.39 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.457 1.098 . . . . 2.3799999999999999 110.947 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.446 ' C ' ' HA ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -104.42 -170.73 1.81 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.471 0.748 . . . . 5.8499999999999996 109.299 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.427 ' CA ' ' O ' ' A' ' 17' ' ' SER . . . -88.27 175.05 44.2 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.507 1.129 . . . . 1.3400000000000001 110.969 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' ND1' ' A' ' 66' ' ' HIS . 0.6 OUTLIER -94.2 36.04 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.474 0.75 . . . . 2.27 111.022 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 2.6899999999999999 109.283 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.994 0 N-CA-C 111.017 -0.833 . . . . 1.1799999999999999 111.017 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.427 ' ND1' ' HB2' ' A' ' 60' ' ' TYR . 5.3 m-70 -125.15 116.28 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 0.765 . . . . 1.26 109.598 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.647 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -40.6 118.63 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.528 1.142 . . . . 0.60999999999999999 109.312 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -78.01 -45.39 23.85 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 5.9900000000000002 110.269 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 68' ' ' ARG . 5.2 p90 177.21 166.94 0.58 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 1.4199999999999999 111.002 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 1.048 ' CD2' HG23 ' A' ' 35' ' ' VAL . 10.9 mt -85.06 136.46 33.56 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.548 1.155 . . . . 1.1799999999999999 109.319 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.554 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.6 138.05 51.72 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.542 1.151 . . . . 0.57999999999999996 109.309 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -81.29 147.19 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.474 1.109 . . . . 3.77 110.306 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.462 0 O-C-N 124.484 1.115 . . . . 2.5099999999999998 108.292 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.326 0 N-CA-C 110.299 -0.26 . . . . 3.2599999999999998 110.299 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.99 149.41 36.71 Favored 'Trans proline' 0 C--N 1.36 1.136 0 O-C-N 124.49 1.784 . . . . 1.1799999999999999 110.954 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -84.77 166.56 31.42 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.133 . . . . 0.69999999999999996 109.316 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.01 173.01 15.26 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.473 1.775 . . . . 0.93000000000000005 110.977 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.1 9.74 29.7 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.539 1.149 . . . . 3.3599999999999999 110.0 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 9' ' ' PRO . 11.8 p -91.05 -36.8 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 2.0899999999999999 108.312 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 33' ' ' VAL . 84.5 t -79.08 115.51 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.63 109.29 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.414 ' OG1' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -83.59 158.12 22.04 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.499 1.124 . . . . 0.97999999999999998 110.404 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.716 HD13 HD21 ' A' ' 70' ' ' LEU . 11.4 tp -113.13 112.22 23.44 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.48 1.113 . . . . 0.68999999999999995 109.292 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.483 ' HB3' ' CB ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -96.19 59.22 1.9 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.518 1.136 . . . . 1.9099999999999999 110.963 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 21' ' ' SER . 6.1 tt0 -78.23 117.83 19.87 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.467 1.104 . . . . 1.52 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.531 ' OG ' ' O ' ' A' ' 20' ' ' TYR . 6.4 p -107.88 -149.36 0.43 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.557 1.16 . . . . 1.1899999999999999 110.001 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.653 ' CE3' ' N ' ' A' ' 19' ' ' ARG . 24.3 p-90 -106.68 -42.81 4.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.499 1.124 . . . . 2.25 108.03 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.653 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -78.31 -33.25 49.42 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 8.1199999999999992 110.339 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.65 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER -167.4 160.08 13.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.136 . . . . 8.4299999999999997 110.979 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.594 ' O ' HG22 ' A' ' 55' ' ' THR . 5.6 m -112.22 144.22 41.99 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.511 1.132 . . . . 2.6200000000000001 110.003 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 1.7 tt0 -126.77 172.75 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.12 . . . . 1.8100000000000001 110.307 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.41 125.15 22.4 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.56 1.163 . . . . 0.60999999999999999 109.273 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.524 ' O ' HG13 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -97.89 137.34 36.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 2.5 109.264 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.48 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 34.9 t-20 -95.69 81.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.78000000000000003 109.252 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.84 20.52 27.93 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.502 1.126 . . . . 1.1599999999999999 110.989 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.406 ' O ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -94.05 10.11 34.95 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.28 -1.007 . . . . 3.0099999999999998 108.28 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.466 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.88 32.68 0.11 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.448 1.092 . . . . 2.0 109.327 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -163.03 138.68 6.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.52 1.138 . . . . 2.0299999999999998 110.299 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -54.62 118.95 4.61 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.96999999999999997 110.423 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.461 HG13 ' O ' ' A' ' 29' ' ' GLU . 34.2 m -143.88 173.4 5.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.485 1.116 . . . . 0.57999999999999996 109.281 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.424 HG23 ' C ' ' A' ' 46' ' ' TYR . 60.0 m -124.56 141.97 51.69 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 0.71999999999999997 110.424 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -141.91 175.34 5.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.092 . . . . 0.63 109.275 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.992 ' CG ' ' HB3' ' A' ' 71' ' ' ALA . 16.0 ptmt -156.6 112.01 2.9 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 3.0800000000000001 109.309 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -56.48 132.4 20.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 0.53000000000000003 109.26 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.874 HG11 ' CZ ' ' A' ' 69' ' ' TYR . 78.6 t -116.96 118.64 59.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 0.77000000000000002 109.328 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -76.44 166.33 23.57 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.505 1.128 . . . . 0.90000000000000002 111.018 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.486 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.91 -9.77 32.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.53 1.144 . . . . 3.0899999999999999 110.312 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -90.47 19.09 5.51 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.142 . . . . 2.6600000000000001 109.344 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.72 13.72 5.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.471 1.107 . . . . 4.2300000000000004 109.291 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -93.31 161.94 14.2 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.139 . . . . 1.0900000000000001 110.401 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.1 mt-10 -135.52 146.08 47.71 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 2.8100000000000001 110.334 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.71 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -73.14 -92.63 0.11 Allowed Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.475 1.109 . . . . 1.8400000000000001 110.967 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 43' ' ' GLY . 42.4 mt -153.31 144.45 23.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.446 0.733 . . . . 1.25 109.306 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.9 m -75.75 105.5 6.82 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.566 1.166 . . . . 2.2799999999999998 108.327 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.424 ' C ' HG23 ' A' ' 32' ' ' THR . 8.1 m-30 -112.97 142.12 46.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.518 1.136 . . . . 1.99 110.979 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.22 122.8 40.65 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.471 1.107 . . . . 0.42999999999999999 109.31 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 ' HB ' ' A' ' 54' ' ' THR . 74.8 t -113.71 140.68 32.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.513 1.133 . . . . 0.34999999999999998 109.281 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.828 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.8 177.54 2.93 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 0.56000000000000005 109.314 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.828 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.4 Cg_endo -74.99 108.49 2.73 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.486 1.782 . . . . 1.02 111.002 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.66 6.41 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.441 1.088 . . . . 0.73999999999999999 111.027 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.894 ' C ' HD13 ' A' ' 53' ' ' ILE . 12.1 tt0 -134.98 157.84 45.88 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.462 0.742 . . . . 2.2200000000000002 110.34 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.894 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -130.22 137.22 56.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.523 1.139 . . . . 1.0700000000000001 109.286 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.524 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -143.68 143.64 31.52 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 0.79000000000000004 110.445 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.2 131.96 45.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.489 1.118 . . . . 1.2 110.422 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.511 HG23 ' HB ' ' A' ' 35' ' ' VAL . 12.2 m -119.09 -10.13 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.476 1.11 . . . . 1.98 109.253 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -171.41 -172.88 37.94 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.501 1.125 . . . . 2.4199999999999999 111.026 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.503 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.5 m-20 -90.11 -166.32 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.504 0.767 . . . . 6.2699999999999996 109.279 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -86.56 170.47 42.38 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.5 1.125 . . . . 1.6399999999999999 111.021 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.566 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -92.6 40.99 1.06 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.517 0.775 . . . . 2.4199999999999999 111.012 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.637 HG23 ' O ' ' A' ' 18' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.496 0 O-C-N 124.461 1.101 . . . . 2.75 109.324 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.049 0 N-CA-C 110.998 -0.841 . . . . 1.1499999999999999 110.998 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.516 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.0 OUTLIER -124.52 119.16 28.32 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.541 0.789 . . . . 1.26 109.56 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 35' ' ' VAL . . . -45.2 108.79 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.491 1.119 . . . . 1.01 109.316 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -77.51 -31.2 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.489 1.118 . . . . 4.5700000000000003 110.314 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.874 ' CZ ' HG11 ' A' ' 36' ' ' VAL . 15.7 p90 -173.93 175.69 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.503 1.127 . . . . 1.1299999999999999 110.973 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.716 HD21 HD13 ' A' ' 14' ' ' LEU . 51.7 mt -106.41 140.2 39.7 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.466 1.104 . . . . 1.1000000000000001 109.294 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.992 ' HB3' ' CG ' ' A' ' 34' ' ' LYS . . . -107.78 142.79 37.27 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.538 1.149 . . . . 0.54000000000000004 109.342 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -87.63 139.92 30.05 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 3.7999999999999998 110.279 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 2.75 108.3 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.293 0 N-CA-C 110.29 -0.263 . . . . 3.9900000000000002 110.29 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 142.65 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.517 1.798 . . . . 0.55000000000000004 111.03 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.32 158.48 56.69 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.499 1.125 . . . . 0.59999999999999998 109.3 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 171.36 18.47 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.472 1.775 . . . . 0.71999999999999997 110.969 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -85.41 9.13 16.49 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.491 1.12 . . . . 2.2200000000000002 109.982 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.8 p -104.74 23.19 13.81 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.509 1.131 . . . . 1.01 108.298 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 24' ' ' ASP . 84.7 t -146.03 116.02 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.461 1.1 . . . . 0.60999999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.435 ' N ' ' O ' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -81.24 161.81 23.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 0.98999999999999999 110.44 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.576 HD13 HG23 ' A' ' 35' ' ' VAL . 16.1 tp -118.63 106.08 12.25 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.481 1.113 . . . . 0.60999999999999999 109.292 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.725 ' HD2' HG21 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -87.24 61.72 6.85 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.475 1.109 . . . . 1.6299999999999999 110.98 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.655 ' CD ' ' HB3' ' A' ' 67' ' ' ALA . 35.4 tt0 -78.24 96.84 5.34 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.572 1.17 . . . . 1.3799999999999999 110.327 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.34 -163.0 0.93 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 2.3199999999999998 109.996 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.69 ' HB2' HG21 ' A' ' 61' ' ' ILE . 66.1 p-90 -99.14 -49.79 4.37 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.479 1.112 . . . . 2.8100000000000001 108.045 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.577 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.03 -21.11 59.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 6.8300000000000001 110.284 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' CB ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -166.87 175.51 7.68 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.577 1.173 . . . . 5.5599999999999996 110.976 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 55' ' ' THR . 6.0 m -141.58 138.5 32.69 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 2.6800000000000002 109.968 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -137.66 -179.97 6.07 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.57 1.169 . . . . 2.3300000000000001 110.284 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -134.03 129.95 36.83 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.68999999999999995 109.33 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.634 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -95.12 136.25 35.67 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.555 1.16 . . . . 4.6299999999999999 109.301 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.475 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.0 t-20 -96.49 87.22 4.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.093 . . . . 0.45000000000000001 109.301 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.44 13.04 53.58 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.526 1.141 . . . . 0.56999999999999995 110.985 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.2 -155.64 0.33 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.328 -0.99 . . . . 1.6000000000000001 108.328 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.59 20.98 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.117 . . . . 1.1399999999999999 109.313 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.408 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -155.95 152.26 27.99 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 2.96 110.29 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.1 m -65.8 125.64 25.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 0.71999999999999997 110.353 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.24 159.52 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.424 1.077 . . . . 0.52000000000000002 109.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.556 HG22 ' HB2' ' A' ' 73' ' ' CYS . 67.1 m -114.58 143.71 44.56 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 0.65000000000000002 110.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.442 HG23 HD22 ' A' ' 70' ' ' LEU . 3.4 m -141.09 177.84 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 0.68000000000000005 109.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.617 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -154.96 105.53 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 1.9099999999999999 109.291 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.727 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -53.7 116.01 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 0.67000000000000004 109.3 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.883 HG22 ' HG2' ' A' ' 42' ' ' GLU . 23.2 t -99.39 120.36 48.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.461 1.101 . . . . 0.51000000000000001 109.292 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.434 ' OH ' ' N ' ' A' ' 58' ' ' ASP . 96.4 m-85 -83.94 167.92 16.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 1.0900000000000001 110.939 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.501 ' CG ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -58.47 -21.5 51.76 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.472 1.108 . . . . 3.98 110.286 179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -79.82 3.56 19.24 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.533 1.146 . . . . 2.29 109.313 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 75.22 3.06 4.02 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.485 1.116 . . . . 4.2199999999999998 109.281 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.43 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.4 p -78.73 144.94 34.78 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.492 1.12 . . . . 0.87 110.404 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.883 ' HG2' HG22 ' A' ' 36' ' ' VAL . 0.4 OUTLIER -121.36 142.38 50.04 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.497 1.123 . . . . 2.48 110.299 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.704 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -60.88 -106.65 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.484 1.115 . . . . 1.8300000000000001 110.961 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 43' ' ' GLY . 47.2 mt -153.02 140.15 19.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 0.773 . . . . 1.28 109.304 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.8 m -42.8 101.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 1.106 . . . . 1.8600000000000001 108.298 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 2.6 m-85 -108.98 111.91 23.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.46 1.1 . . . . 2.3999999999999999 111.031 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.83 128.84 35.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.52 1.138 . . . . 0.55000000000000004 109.332 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.663 HG22 ' HB ' ' A' ' 54' ' ' THR . 69.6 t -128.79 140.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.465 1.103 . . . . 0.33000000000000002 109.356 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.686 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.51 171.77 11.5 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.515 1.134 . . . . 0.46999999999999997 109.292 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.686 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.5 Cg_endo -74.97 102.52 1.6 Allowed 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.475 1.776 . . . . 0.66000000000000003 111.044 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 105.13 36.55 2.89 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.507 1.129 . . . . 0.66000000000000003 110.989 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.748 ' C ' HD13 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -144.94 158.27 43.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.545 0.791 . . . . 2.2400000000000002 110.291 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.748 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -126.68 141.75 45.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.444 1.09 . . . . 0.95999999999999996 109.326 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.663 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -146.45 141.31 27.0 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.476 1.11 . . . . 0.76000000000000001 110.376 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.58 141.5 54.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 1.25 110.408 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 15.3 m -129.59 1.21 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 2.3700000000000001 109.311 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 21' ' ' SER . . . 164.37 -173.48 40.34 Favored Glycine 0 CA--C 1.529 0.962 0 O-C-N 124.55 1.156 . . . . 2.2999999999999998 111.048 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.434 ' N ' ' OH ' ' A' ' 37' ' ' TYR . 7.9 m-20 -92.61 -173.58 3.4 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 0.777 . . . . 5.8700000000000001 109.305 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -83.68 -176.78 51.44 Favored Glycine 0 CA--C 1.53 0.98 0 O-C-N 124.551 1.157 . . . . 1.22 111.03 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.567 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 3.9 p90 -101.13 27.95 5.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.501 0.765 . . . . 2.6899999999999999 111.016 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.69 HG21 ' HB2' ' A' ' 18' ' ' TRP . 1.3 pp . . . . . 0 C--N 1.325 -0.478 0 O-C-N 124.512 1.132 . . . . 2.8100000000000001 109.317 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.975 0 N-CA-C 111.004 -0.838 . . . . 1.28 111.004 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.567 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 10.6 m170 -107.93 107.0 17.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 0.764 . . . . 2.4500000000000002 109.589 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.655 ' HB3' ' CD ' ' A' ' 16' ' ' GLN . . . -39.66 113.18 0.31 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.493 1.12 . . . . 0.60999999999999999 109.28 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -78.14 -38.34 43.95 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.119 . . . . 6.0899999999999999 110.317 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.502 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 18.1 p90 179.53 -166.12 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.492 1.12 . . . . 1.1299999999999999 111.02 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 35' ' ' VAL . 70.9 mt -115.24 138.24 51.16 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.527 1.142 . . . . 1.26 109.32 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.617 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.42 139.4 50.48 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.499 1.124 . . . . 0.60999999999999999 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.8 147.3 51.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.536 1.147 . . . . 3.1699999999999999 110.344 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.556 ' HB2' HG22 ' A' ' 32' ' ' THR . 40.7 t . . . . . 0 C--N 1.325 -0.494 0 O-C-N 124.461 1.101 . . . . 2.6600000000000001 108.307 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.418 ' CG ' ' HB2' ' A' ' 72' ' ' ARG . 43.1 tp10 . . . . . 0 N--CA 1.453 -0.281 0 N-CA-C 110.282 -0.266 . . . . 3.4199999999999999 110.282 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 139.6 24.46 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.524 1.802 . . . . 0.67000000000000004 110.998 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.622 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 168.45 0.95 Allowed Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 0.60999999999999999 109.313 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.622 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.3 Cg_endo -75.0 170.0 21.39 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.518 1.799 . . . . 0.80000000000000004 111.004 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.54 13.31 12.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 2.2799999999999998 110.024 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.2 p -112.65 21.46 15.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.492 1.12 . . . . 0.95999999999999996 108.294 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.592 HG22 ' HA ' ' A' ' 25' ' ' ASN . 3.1 t -139.5 123.04 18.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 0.67000000000000004 109.28 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 154.31 19.21 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.436 1.085 . . . . 1.1000000000000001 110.409 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.966 HD13 HD21 ' A' ' 70' ' ' LEU . 6.1 tp -108.07 111.96 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 0.54000000000000004 109.319 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -93.23 58.06 2.8 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 1.51 110.97 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.657 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.1 tt0 -74.48 98.43 3.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.52 1.138 . . . . 1.51 110.311 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.493 ' HG ' ' H ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -92.6 -160.84 0.78 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.483 1.115 . . . . 1.22 109.998 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.825 ' O ' HD11 ' A' ' 61' ' ' ILE . 29.8 p-90 -99.5 -46.48 5.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 2.8900000000000001 107.97 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -71.67 -34.24 69.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 5.7400000000000002 110.307 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.567 ' CD2' HG21 ' A' ' 55' ' ' THR . 0.1 OUTLIER -167.45 157.29 10.62 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.138 . . . . 6.0700000000000003 111.005 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 2.8 t -105.94 134.96 48.23 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 1.9199999999999999 110.01 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.566 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 9.5 mt-30 -125.74 172.15 10.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 2.0800000000000001 110.259 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.795 ' HB2' HG11 ' A' ' 56' ' ' VAL . . . -134.76 129.23 34.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.523 1.14 . . . . 0.5 109.301 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 25' ' ' ASN . 2.8 t0 -102.65 133.46 47.62 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 2.2000000000000002 109.288 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.592 ' HA ' HG22 ' A' ' 12' ' ' VAL . 60.8 t-20 -93.67 93.77 8.21 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.489 1.118 . . . . 0.5 109.262 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.51 9.6 70.23 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.519 1.137 . . . . 0.60999999999999999 110.993 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.55 -167.71 1.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 1.6399999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.422 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -125.2 25.44 7.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.576 1.173 . . . . 1.1499999999999999 109.3 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.411 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 10.3 mt-10 -158.09 144.82 17.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.502 1.126 . . . . 2.2999999999999998 110.28 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.0 m -61.78 128.89 38.41 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.454 1.096 . . . . 0.73999999999999999 110.359 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.21 162.25 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.497 1.123 . . . . 0.52000000000000002 109.282 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.495 HG22 ' HB2' ' A' ' 73' ' ' CYS . 49.0 m -111.94 143.61 42.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.469 1.106 . . . . 0.54000000000000004 110.405 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.438 HG11 HG11 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -140.71 177.94 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.453 1.096 . . . . 0.54000000000000004 109.318 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -160.67 110.48 1.73 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.55 1.156 . . . . 2.02 109.329 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.804 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -61.88 114.35 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.46 1.1 . . . . 0.71999999999999997 109.273 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.952 HG22 ' HG2' ' A' ' 42' ' ' GLU . 84.7 t -96.05 117.62 40.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.502 1.126 . . . . 0.5 109.286 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.498 ' OH ' ' N ' ' A' ' 58' ' ' ASP . 25.2 m-85 -75.45 173.47 10.92 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 1.72 111.048 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 1.8 mm-40 -81.16 -12.06 59.3 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.462 1.102 . . . . 3.6400000000000001 110.255 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.457 ' CG ' ' OG1' ' A' ' 41' ' ' THR . 5.2 p-10 -93.73 34.0 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.102 . . . . 2.6499999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.44 ' O ' HG23 ' A' ' 41' ' ' THR . 1.7 m-20 46.96 67.38 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.133 . . . . 4.2599999999999998 109.306 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.457 ' OG1' ' CG ' ' A' ' 39' ' ' ASP . 1.0 OUTLIER -152.29 152.16 31.81 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.463 1.102 . . . . 0.92000000000000004 110.357 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.9 mt-10 -130.9 139.58 50.11 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 2.0499999999999998 110.313 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -58.95 -103.94 0.01 OUTLIER Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.537 1.148 . . . . 1.72 110.996 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.685 HD23 ' O ' ' A' ' 43' ' ' GLY . 45.1 mt -153.6 139.66 18.3 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 1.3200000000000001 109.319 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.7 m -51.53 103.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.496 1.123 . . . . 1.6299999999999999 108.328 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 33.2 m-85 -112.05 122.87 48.96 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 1.72 111.017 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.67 123.77 38.3 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.493 1.121 . . . . 0.5 109.301 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 25' ' ' ASN . 68.2 t -122.36 138.34 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.499 1.124 . . . . 0.35999999999999999 109.318 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.726 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.93 173.51 7.61 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.52 1.137 . . . . 0.48999999999999999 109.35 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.726 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 97.74 1.1 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.487 1.783 . . . . 0.65000000000000002 111.0 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 109.9 35.27 2.22 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.507 1.13 . . . . 0.80000000000000004 110.967 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.723 ' C ' HD13 ' A' ' 53' ' ' ILE . 3.2 mt-30 -140.05 159.48 42.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.511 0.771 . . . . 3.54 110.289 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.723 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -128.82 140.27 49.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 O-C-N 124.496 1.122 . . . . 0.98999999999999999 109.284 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.544 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.6 OUTLIER -148.05 147.76 29.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.556 1.16 . . . . 0.95999999999999996 110.418 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.567 HG21 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -60.94 146.15 47.83 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.508 1.13 . . . . 1.6299999999999999 110.427 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.795 HG11 ' HB2' ' A' ' 23' ' ' ALA . 29.5 m -132.64 -0.54 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.479 1.112 . . . . 2.6600000000000001 109.332 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 162.52 -169.46 37.8 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.519 1.137 . . . . 2.25 111.014 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.51 ' O ' ' CB ' ' A' ' 21' ' ' SER . 4.4 m-20 -89.67 -164.63 1.18 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.513 0.773 . . . . 5.6699999999999999 109.309 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -86.53 -169.06 45.54 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.514 1.134 . . . . 1.1399999999999999 111.007 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.546 ' CD2' HG23 ' A' ' 61' ' ' ILE . 18.5 p90 -90.86 -7.09 53.23 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.537 0.786 . . . . 1.9199999999999999 110.975 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.825 HD11 ' O ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.552 1.158 . . . . 2.9500000000000002 109.32 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.016 0 N-CA-C 111.011 -0.836 . . . . 0.83999999999999997 111.011 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.583 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -118.82 131.29 56.09 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.535 0.785 . . . . 1.22 109.644 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.657 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -46.33 122.59 4.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.67000000000000004 109.309 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -77.9 -47.38 18.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.575 1.172 . . . . 5.5 110.287 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CE2' ' HD2' ' A' ' 68' ' ' ARG . 6.2 p90 -174.85 -177.5 1.13 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.496 1.123 . . . . 1.0600000000000001 110.988 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.966 HD21 HD13 ' A' ' 14' ' ' LEU . 7.9 mt -105.69 135.05 47.8 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.551 1.157 . . . . 1.51 109.28 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 6' ' ' GLU . . . -123.19 148.52 45.71 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.507 1.129 . . . . 0.54000000000000004 109.295 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB2' ' CG ' ' A' ' 6' ' ' GLU . 3.6 mtt180 -81.3 154.49 26.51 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.511 1.132 . . . . 4.3300000000000001 110.301 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 32' ' ' THR . 38.1 t . . . . . 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.124 . . . . 2.6299999999999999 108.324 179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 0.6 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 N-CA-C 110.311 -0.255 . . . . 3.0699999999999998 110.311 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 148.88 35.75 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.552 1.817 . . . . 0.76000000000000001 110.978 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -76.07 150.35 83.21 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.109 . . . . 1.28 109.325 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.425 ' HD3' ' NE ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 -176.1 2.71 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.435 1.755 . . . . 1.5800000000000001 110.985 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.52 6.34 20.81 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.456 1.098 . . . . 1.8300000000000001 109.988 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 26' ' ' GLY . 2.0 p -96.42 20.09 11.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.533 1.146 . . . . 1.1399999999999999 108.327 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.576 HG21 ' NH1' ' A' ' 72' ' ' ARG . 70.0 t -149.47 121.83 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.517 1.135 . . . . 0.63 109.257 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.47 136.75 36.54 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.531 1.145 . . . . 1.0700000000000001 110.385 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.483 ' HA ' HD11 ' A' ' 70' ' ' LEU . 32.5 tp -89.98 105.53 17.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.545 1.153 . . . . 0.62 109.311 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.545 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -96.44 65.44 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.446 1.091 . . . . 1.27 110.958 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.674 ' OE1' ' HB3' ' A' ' 67' ' ' ALA . 17.4 tt0 -77.2 120.63 22.53 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 1.55 110.278 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.592 ' O ' ' CD2' ' A' ' 60' ' ' TYR . 6.4 p -87.77 -144.22 0.13 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.476 1.11 . . . . 1.3700000000000001 109.976 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.983 ' O ' HD12 ' A' ' 61' ' ' ILE . 32.4 p-90 -101.74 -54.76 2.66 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 108.012 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.637 ' HB3' ' CE3' ' A' ' 18' ' ' TRP . 2.8 ptt180 -107.67 14.75 25.32 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.489 1.118 . . . . 5.5099999999999998 110.299 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.616 ' CD1' ' HA2' ' A' ' 57' ' ' GLY . 0.2 OUTLIER -168.24 176.26 6.05 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.502 1.126 . . . . 5.4800000000000004 110.99 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.488 ' OG ' ' N ' ' A' ' 58' ' ' ASP . 5.1 p -143.61 159.73 41.93 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.496 1.122 . . . . 2.3300000000000001 110.022 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.545 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 3.2 mt-30 -141.26 135.92 31.12 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.49 1.118 . . . . 2.04 110.333 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.411 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -100.51 117.87 35.55 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.47 1.106 . . . . 0.60999999999999999 109.258 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 24' ' ' ASP . 2.2 t0 -98.22 113.7 25.72 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.502 1.126 . . . . 2.7200000000000002 109.272 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.608 ' HB2' HG12 ' A' ' 48' ' ' VAL . 58.5 t-20 -78.16 102.19 7.42 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.524 1.14 . . . . 0.63 109.249 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.7 3.52 81.38 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.452 1.095 . . . . 0.68000000000000005 110.985 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.13 -161.76 0.58 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.342 -0.985 . . . . 1.45 108.342 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.464 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -130.5 21.22 5.15 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 1.3400000000000001 109.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.428 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -153.31 147.55 25.75 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.469 1.106 . . . . 3.4300000000000002 110.357 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.8 m -59.47 127.87 34.21 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.492 1.12 . . . . 0.76000000000000001 110.392 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.518 HG21 HH12 ' A' ' 72' ' ' ARG . 15.9 m -141.87 154.06 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.513 1.133 . . . . 0.76000000000000001 109.329 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.688 HG21 ' SG ' ' A' ' 45' ' ' CYS . 1.8 m -101.73 141.19 34.97 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.524 1.14 . . . . 0.84999999999999998 110.425 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.411 HG21 ' CB ' ' A' ' 23' ' ' ALA . 1.8 m -129.93 170.69 18.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.445 1.091 . . . . 0.87 109.345 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.836 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 2.0 ptmt -160.64 89.46 0.82 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.504 1.128 . . . . 2.3700000000000001 109.289 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.91 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.8 OUTLIER -40.03 139.01 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.68999999999999995 109.35 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.906 HG22 ' HG2' ' A' ' 42' ' ' GLU . 75.0 t -118.03 117.29 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.531 1.144 . . . . 0.90000000000000002 109.282 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.417 ' OH ' ' OD1' ' A' ' 58' ' ' ASP . 78.4 m-85 -73.64 166.55 23.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 0.98999999999999999 110.984 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -5.59 33.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.505 1.128 . . . . 3.27 110.297 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.4 9.4 31.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.424 1.077 . . . . 2.6200000000000001 109.337 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.459 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 78.52 -1.25 2.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.479 1.112 . . . . 3.9300000000000002 109.293 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.2 p -83.2 167.63 17.54 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.539 1.149 . . . . 1.22 110.395 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.906 ' HG2' HG22 ' A' ' 36' ' ' VAL . 16.3 mt-10 -134.54 170.28 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.475 1.109 . . . . 2.1699999999999999 110.306 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.564 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -83.83 -115.57 0.63 Allowed Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.554 1.159 . . . . 2.0 111.017 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 43' ' ' GLY . 36.1 mt -148.44 147.58 29.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.501 0.766 . . . . 1.6100000000000001 109.299 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.688 ' SG ' HG21 ' A' ' 32' ' ' THR . 0.4 OUTLIER -47.2 120.33 3.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 1.112 . . . . 2.1299999999999999 108.285 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 1.116 ' CD2' HG12 ' A' ' 56' ' ' VAL . 6.1 m-85 -137.22 108.05 6.65 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.141 . . . . 1.8999999999999999 110.973 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.27 134.61 34.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.56999999999999995 109.255 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.809 HG22 ' HB ' ' A' ' 54' ' ' THR . 49.7 t -133.11 141.74 43.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.448 1.092 . . . . 0.33000000000000002 109.302 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.78 167.08 35.13 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.474 1.109 . . . . 0.53000000000000003 109.291 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -75.09 117.98 5.08 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.514 1.797 . . . . 0.87 110.954 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.6 28.76 18.25 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.492 1.12 . . . . 1.02 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.937 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -132.16 167.18 20.21 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.483 0.755 . . . . 2.4500000000000002 110.297 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.937 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -135.75 125.11 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 1.1200000000000001 109.284 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.809 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -125.78 137.23 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.124 . . . . 1.0 110.381 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 21' ' ' SER . 6.1 m -82.03 127.65 33.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.487 1.117 . . . . 1.9099999999999999 110.431 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 1.116 HG12 ' CD2' ' A' ' 46' ' ' TYR . 3.6 m -95.83 -51.97 10.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.522 1.138 . . . . 3.21 109.36 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.616 ' HA2' ' CD1' ' A' ' 20' ' ' TYR . . . 119.63 89.6 1.2 Allowed Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.517 1.136 . . . . 2.73 110.993 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.843 ' CG ' HG11 ' A' ' 35' ' ' VAL . 7.7 m-20 -170.24 126.32 0.79 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.508 0.77 . . . . 6.1799999999999997 109.354 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -131.76 162.27 23.8 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.494 1.121 . . . . 1.28 110.993 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.754 ' CE1' HG22 ' A' ' 61' ' ' ILE . 42.6 p90 -95.54 -6.94 39.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 0.762 . . . . 2.1299999999999999 111.023 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.326 -0.454 0 O-C-N 124.484 1.115 . . . . 2.3999999999999999 109.269 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.021 0 N-CA-C 110.978 -0.849 . . . . 0.91000000000000003 110.978 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.579 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -116.45 165.08 13.63 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.507 0.769 . . . . 1.1599999999999999 109.575 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.674 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -83.01 121.6 27.22 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.561 1.163 . . . . 0.70999999999999996 109.321 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -75.74 -46.3 31.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.419 1.075 . . . . 4.5099999999999998 110.273 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 17.9 p90 178.92 161.74 0.72 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.494 1.121 . . . . 1.6100000000000001 111.002 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.91 ' CD2' HG23 ' A' ' 35' ' ' VAL . 17.4 mt -81.57 139.96 34.76 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.5 1.125 . . . . 1.3999999999999999 109.311 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.836 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -117.22 132.06 56.72 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.482 1.114 . . . . 0.62 109.319 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.576 ' NH1' HG21 ' A' ' 12' ' ' VAL . 3.9 mmt180 -63.5 144.87 56.62 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 5.5899999999999999 110.295 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 50.9 t . . . . . 0 C--N 1.324 -0.504 0 O-C-N 124.547 1.155 . . . . 2.73 108.276 -179.965 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 . . . . . 0 N--CA 1.453 -0.276 0 N-CA-C 110.278 -0.267 . . . . 4.3399999999999999 110.278 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 134.73 18.24 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.524 1.802 . . . . 0.69999999999999996 111.024 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -58.37 166.75 2.04 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.496 1.122 . . . . 0.66000000000000003 109.322 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.632 ' HB3' HH21 ' A' ' 72' ' ' ARG . 18.3 Cg_endo -75.05 176.1 10.37 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.509 1.794 . . . . 0.77000000000000002 111.027 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 t -92.2 13.99 17.52 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.479 1.112 . . . . 2.5099999999999998 110.0 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 7.4 p -99.94 -18.23 17.18 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.5 1.125 . . . . 1.1599999999999999 108.29 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.834 HG12 HD12 ' A' ' 70' ' ' LEU . 1.4 t -97.77 117.9 43.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.548 1.155 . . . . 1.01 109.303 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.98 139.55 30.48 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.461 1.101 . . . . 1.25 110.39 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.87 HD13 HD21 ' A' ' 70' ' ' LEU . 10.3 tp -96.86 114.12 25.72 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 0.77000000000000002 109.283 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.8 OUTLIER -106.97 70.37 0.8 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 1.23 111.002 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.732 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 24.9 tt0 -78.6 127.8 32.62 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 1.3999999999999999 110.317 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.596 ' O ' ' CE2' ' A' ' 60' ' ' TYR . 1.7 p -110.8 -151.63 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.52 1.138 . . . . 1.1100000000000001 109.985 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.671 ' HB2' HG21 ' A' ' 61' ' ' ILE . 28.1 p-90 -97.5 -47.49 5.64 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.524 1.14 . . . . 2.1899999999999999 108.026 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -37.55 55.29 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.128 . . . . 6.0800000000000001 110.278 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.547 ' C ' ' O ' ' A' ' 58' ' ' ASP . 6.4 p90 -166.22 -177.06 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.561 1.163 . . . . 7.2000000000000002 110.981 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 55' ' ' THR . 27.4 t -117.97 164.07 15.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 2.73 109.968 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -138.41 130.34 28.23 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 1.95 110.286 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -95.1 119.37 33.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 0.56999999999999995 109.301 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.626 ' HA ' HG23 ' A' ' 53' ' ' ILE . 2.1 t0 -97.68 115.59 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 2.25 109.26 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' A' ' 49' ' ' ALA . 38.3 t-20 -77.59 84.56 3.95 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.474 1.109 . . . . 0.66000000000000003 109.269 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.78 15.7 59.96 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.502 1.127 . . . . 0.67000000000000004 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.413 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -93.78 11.35 29.52 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.313 -0.995 . . . . 2.7599999999999998 108.313 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.5 32.45 0.09 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 2.02 109.321 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -158.01 133.72 9.07 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.555 1.159 . . . . 2.5899999999999999 110.321 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.42 HG23 ' HA ' ' A' ' 49' ' ' ALA . 3.0 m -50.23 119.33 3.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 0.89000000000000001 110.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 29' ' ' GLU . 27.4 m -145.82 163.68 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.456 1.098 . . . . 0.65000000000000002 109.304 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 47' ' ' ALA . 23.3 m -117.66 146.63 43.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.535 1.147 . . . . 0.66000000000000003 110.409 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.548 HG11 HG11 ' A' ' 12' ' ' VAL . 1.1 m -142.31 176.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.512 1.133 . . . . 0.57999999999999996 109.308 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.828 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 0.7 OUTLIER -160.19 103.56 1.45 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 2.4700000000000002 109.338 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 1.043 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -60.44 137.03 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.56000000000000005 109.341 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.885 HG22 ' HG2' ' A' ' 42' ' ' GLU . 13.0 t -116.64 124.23 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.85999999999999999 109.275 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.664 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 54.6 m-85 -76.26 166.71 23.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.466 1.104 . . . . 1.03 111.03 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 1.2 tt0 -61.42 -14.38 27.79 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 3.6200000000000001 110.29 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -84.87 7.93 19.23 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 1.97 109.265 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 t0 71.92 6.21 5.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.09 . . . . 3.9300000000000002 109.278 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.597 HG23 ' HB2' ' A' ' 39' ' ' ASP . 42.5 p -87.35 151.3 23.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 0.98999999999999999 110.409 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.885 ' HG2' HG22 ' A' ' 36' ' ' VAL . 4.6 mt-10 -118.52 141.42 48.58 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.512 1.132 . . . . 1.9399999999999999 110.338 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -65.89 -94.54 0.03 OUTLIER Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.475 1.109 . . . . 1.77 111.0 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 43' ' ' GLY . 50.8 mt -153.84 139.86 18.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.554 0.797 . . . . 1.3100000000000001 109.333 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 113.91 8.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.505 1.128 . . . . 1.6299999999999999 108.324 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.456 ' HD2' HG12 ' A' ' 56' ' ' VAL . 3.3 m-85 -124.03 138.47 54.44 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 1.138 . . . . 2.0600000000000001 111.019 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -96.09 115.6 27.68 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.506 1.129 . . . . 0.64000000000000001 109.318 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.968 HG22 ' HB ' ' A' ' 54' ' ' THR . 96.5 t -99.72 131.94 46.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 O-C-N 124.511 1.132 . . . . 0.51000000000000001 109.36 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -68.44 171.97 5.19 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 0.94999999999999996 109.334 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -74.99 111.54 3.35 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.5 1.789 . . . . 1.46 110.981 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.33 21.58 44.31 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.52 1.137 . . . . 0.68000000000000005 111.016 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.863 ' HG3' HG13 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -123.03 155.27 37.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.514 0.773 . . . . 2.8799999999999999 110.268 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.626 HG23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -122.36 129.49 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.529 1.143 . . . . 1.1799999999999999 109.328 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.968 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -126.92 138.6 53.32 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.459 1.099 . . . . 0.94999999999999996 110.425 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.534 ' CG2' ' CD1' ' A' ' 20' ' ' TYR . 2.0 m -78.41 139.48 38.75 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 1.3200000000000001 110.347 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 35' ' ' VAL . 3.6 m -113.51 -50.49 5.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.548 1.155 . . . . 2.2200000000000002 109.291 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.463 ' O ' HG11 ' A' ' 35' ' ' VAL . . . 132.53 123.14 2.41 Favored Glycine 0 CA--C 1.531 1.037 0 O-C-N 124.471 1.107 . . . . 2.8999999999999999 110.962 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.664 ' OD1' ' CE2' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 165.78 127.13 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.536 0.786 . . . . 7.0300000000000002 109.278 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -147.52 123.42 1.73 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.51 1.131 . . . . 1.3999999999999999 110.983 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB2' ' CE1' ' A' ' 66' ' ' HIS . 15.2 p90 -70.39 1.87 4.52 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.48 0.753 . . . . 2.6200000000000001 111.008 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.671 HG21 ' HB2' ' A' ' 18' ' ' TRP . 9.6 tt . . . . . 0 C--N 1.325 -0.477 0 O-C-N 124.461 1.101 . . . . 4.6399999999999997 109.316 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.972 0 N-CA-C 111.002 -0.839 . . . . 1.0900000000000001 111.002 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 60' ' ' TYR . 1.7 m170 -120.53 135.73 54.99 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.482 0.754 . . . . 1.45 109.611 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.732 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -36.73 134.59 0.48 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 0.89000000000000001 109.329 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.563 ' CD ' ' HA ' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -91.49 -47.24 7.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.473 1.108 . . . . 4.7800000000000002 110.269 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.582 ' CD1' ' HB ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -178.11 173.95 1.42 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 2.25 110.993 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 1.043 ' CD2' HG23 ' A' ' 35' ' ' VAL . 4.5 mt -96.85 144.78 26.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.486 1.117 . . . . 1.5 109.249 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.828 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -125.94 129.58 49.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.494 1.121 . . . . 0.47999999999999998 109.289 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.632 HH21 ' HB3' ' A' ' 9' ' ' PRO . 4.5 ptp180 -85.57 141.74 29.63 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.53 1.144 . . . . 3.79 110.316 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 2.1000000000000001 108.305 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 1.8 tt0 . . . . . 0 N--CA 1.453 -0.288 0 N-CA-C 110.238 -0.282 . . . . 3.0 110.238 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 138.37 22.88 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.512 1.796 . . . . 0.71999999999999997 110.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.67 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.68 170.09 0.31 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 0.67000000000000004 109.309 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.67 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.03 167.46 26.98 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.474 1.776 . . . . 0.94999999999999996 110.977 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 45.5 p -85.06 7.67 20.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.517 1.136 . . . . 2.6000000000000001 110.008 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 6.1 p -114.76 29.79 7.78 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 1.01 108.255 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 33' ' ' VAL . 89.1 t -143.25 109.66 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.536 1.148 . . . . 0.63 109.299 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.43 153.79 29.43 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 0.91000000000000003 110.436 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.525 HD13 HG23 ' A' ' 35' ' ' VAL . 15.1 tp -105.23 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.443 1.09 . . . . 0.54000000000000004 109.327 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -88.64 57.27 4.11 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.541 1.15 . . . . 1.71 110.946 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.533 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 25.6 tt0 -76.26 100.71 5.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 1.3999999999999999 110.3 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.627 ' O ' ' CE1' ' A' ' 60' ' ' TYR . 1.4 p -77.79 -150.41 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.445 1.091 . . . . 1.0900000000000001 109.984 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 1.101 ' CA ' HD11 ' A' ' 61' ' ' ILE . 34.6 p-90 -98.45 -65.18 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.045 -1.094 . . . . 2.2000000000000002 108.045 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.594 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -93.1 16.68 12.33 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.486 1.116 . . . . 5.8600000000000003 110.329 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 1.082 ' CE2' HG21 ' A' ' 55' ' ' THR . 0.0 OUTLIER -168.71 161.62 11.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 5.0099999999999998 110.984 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.486 ' OG ' ' C ' ' A' ' 57' ' ' GLY . 65.1 p -143.28 135.6 27.16 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 110.027 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.609 ' OE1' HG23 ' A' ' 55' ' ' THR . 0.0 OUTLIER -135.25 177.87 7.47 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.507 1.129 . . . . 2.4500000000000002 110.314 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.23 133.72 39.28 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.524 1.14 . . . . 0.65000000000000002 109.266 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG1' ' A' ' 53' ' ' ILE . 39.8 t0 -103.29 130.44 50.56 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 2.29 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.638 ' HB2' HG12 ' A' ' 48' ' ' VAL . 23.7 t-20 -84.4 96.87 9.21 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.444 1.09 . . . . 0.62 109.285 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -86.47 2.01 87.36 Favored Glycine 0 CA--C 1.529 0.968 0 O-C-N 124.53 1.144 . . . . 0.64000000000000001 111.023 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.465 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -88.94 -157.76 0.46 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.272 -1.01 . . . . 1.6200000000000001 108.272 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.414 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -131.1 16.29 5.1 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 1.1499999999999999 109.315 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -144.14 152.15 40.53 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.562 1.164 . . . . 2.9900000000000002 110.285 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 48' ' ' VAL . 90.7 m -71.48 130.8 42.19 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.528 1.143 . . . . 1.0 110.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.8 m -141.46 164.0 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.467 1.105 . . . . 0.59999999999999998 109.294 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 ' SG ' ' A' ' 73' ' ' CYS . 74.9 m -113.25 141.44 46.99 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.67000000000000004 110.415 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 12' ' ' VAL . 1.2 m -137.74 174.17 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.468 1.105 . . . . 0.56999999999999995 109.282 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.645 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 5.3 pttt -155.33 105.21 2.47 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 1.9399999999999999 109.316 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.595 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.27 115.65 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.516 1.135 . . . . 0.78000000000000003 109.248 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.876 HG22 ' HG2' ' A' ' 42' ' ' GLU . 99.2 t -98.85 119.3 46.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.56000000000000005 109.277 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 67' ' ' ALA . 68.7 m-85 -78.61 170.05 17.26 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 1.22 110.998 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG3' ' CG ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -68.05 -12.45 60.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.527 1.142 . . . . 4.46 110.297 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.3 16.62 7.13 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.504 1.128 . . . . 1.8 109.285 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.2 t0 65.22 10.68 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 3.9199999999999999 109.306 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.445 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.1 OUTLIER -83.99 155.07 22.95 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.547 1.154 . . . . 1.23 110.381 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.876 ' HG2' HG22 ' A' ' 36' ' ' VAL . 13.0 mt-10 -133.33 127.07 32.75 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.485 1.116 . . . . 2.3300000000000001 110.273 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.721 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -52.29 -105.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.496 1.123 . . . . 1.79 110.989 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.721 HD23 ' O ' ' A' ' 43' ' ' GLY . 49.9 mt -153.23 138.06 17.09 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.442 0.731 . . . . 1.4199999999999999 109.302 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.429 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -55.05 112.08 0.98 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.529 1.143 . . . . 1.3899999999999999 108.282 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.598 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 35.2 m-85 -121.74 123.71 42.48 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.525 1.141 . . . . 1.52 110.983 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.45 120.18 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.53 1.144 . . . . 0.46000000000000002 109.3 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.638 HG12 ' HB2' ' A' ' 25' ' ' ASN . 53.4 t -115.9 142.7 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.495 1.122 . . . . 0.40000000000000002 109.331 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.654 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -86.31 169.47 15.18 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.554 1.159 . . . . 0.51000000000000001 109.352 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.654 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.0 104.84 1.97 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.517 1.798 . . . . 0.75 111.02 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.86 34.78 2.93 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.494 1.121 . . . . 0.76000000000000001 111.022 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -152.33 158.08 42.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.461 0.741 . . . . 2.3399999999999999 110.276 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' ' HA ' ' A' ' 24' ' ' ASP . 8.0 mt -126.21 153.33 34.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.478 1.111 . . . . 2.02 109.294 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.536 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.5 OUTLIER -153.65 142.94 21.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.459 1.099 . . . . 0.85999999999999999 110.401 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 1.082 HG21 ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -62.84 142.89 58.04 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 1.26 110.391 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.52 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 4.4 m -122.92 -7.28 8.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 2.0499999999999998 109.29 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.486 ' C ' ' OG ' ' A' ' 21' ' ' SER . . . 159.48 -156.17 27.3 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.485 1.115 . . . . 2.3799999999999999 111.027 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.452 ' HA ' ' HA ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -91.65 179.0 5.76 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 0.773 . . . . 6.21 109.304 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.471 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -89.45 -145.43 12.25 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.542 1.151 . . . . 1.4299999999999999 110.959 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.627 ' CE1' ' O ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -98.46 -1.2 41.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.491 0.76 . . . . 2.7200000000000002 110.968 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 1.101 HD11 ' CA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.481 0 O-C-N 124.472 1.107 . . . . 4.4000000000000004 109.341 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.982 0 N-CA-C 111.01 -0.836 . . . . 0.90000000000000002 111.01 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.529 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.8 OUTLIER -121.27 123.49 42.33 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.522 0.778 . . . . 1.1200000000000001 109.56 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.533 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -43.06 117.76 1.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 0.56000000000000005 109.306 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -76.62 -40.9 47.9 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 4.4299999999999997 110.326 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 12.5 p90 -178.24 -170.21 0.22 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.541 1.15 . . . . 1.02 110.959 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.595 HD23 ' HA ' ' A' ' 35' ' ' VAL . 51.8 mt -114.64 134.5 55.02 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.516 1.135 . . . . 1.1599999999999999 109.329 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.645 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -113.92 130.0 56.55 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.478 1.111 . . . . 0.53000000000000003 109.297 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.444 HH21 ' HB3' ' A' ' 9' ' ' PRO . 3.3 ptp180 -86.49 138.69 31.54 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 4.6600000000000001 110.276 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.467 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.324 -0.503 0 O-C-N 124.486 1.116 . . . . 2.4199999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.56 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 1.3 tt0 . . . . . 0 N--CA 1.453 -0.32 0 N-CA-C 110.267 -0.272 . . . . 3.73 110.267 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 142.93 28.56 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.538 1.81 . . . . 0.70999999999999996 111.031 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.884 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -74.43 179.81 1.2 Allowed Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.482 1.114 . . . . 0.75 109.296 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.884 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.4 Cg_endo -74.94 165.19 31.88 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.545 1.813 . . . . 0.94999999999999996 111.018 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.7 m -90.47 16.26 9.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.554 1.159 . . . . 2.3100000000000001 110.006 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.455 ' O ' ' N ' ' A' ' 26' ' ' GLY . 26.6 p -108.43 12.28 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.493 1.121 . . . . 0.90000000000000002 108.293 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 33' ' ' VAL . 75.4 t -128.07 117.57 46.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 0.68999999999999995 109.288 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.34 145.45 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.96999999999999997 110.386 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.572 HD13 HD21 ' A' ' 70' ' ' LEU . 43.9 tp -101.63 105.46 16.4 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 0.58999999999999997 109.326 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.547 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -98.08 65.91 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 1.3600000000000001 110.999 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.71 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 6.7 tt0 -79.5 118.27 21.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.449 1.093 . . . . 1.3300000000000001 110.312 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -100.84 -157.55 0.62 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.505 1.128 . . . . 1.22 110.007 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.876 ' HB2' HG23 ' A' ' 61' ' ' ILE . 62.9 p-90 -96.06 -45.35 6.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.522 1.139 . . . . 2.04 107.991 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 17.9 ptt180 -77.53 -37.02 51.78 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.45 1.094 . . . . 7.1500000000000004 110.31 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.633 ' CD2' ' HA2' ' A' ' 57' ' ' GLY . 0.3 OUTLIER -164.6 173.7 11.67 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 7.0199999999999996 111.01 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.51 ' O ' ' CG2' ' A' ' 55' ' ' THR . 54.4 p -116.75 158.12 24.38 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 2.1699999999999999 109.992 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.798 ' HG2' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -142.76 134.44 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.475 1.109 . . . . 3.04 110.315 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.463 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -98.01 128.68 44.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 0.44 109.282 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -106.22 120.4 41.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.547 1.155 . . . . 2.48 109.32 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.639 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.6 t-20 -77.81 89.98 4.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.549 1.155 . . . . 0.52000000000000002 109.286 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -83.98 8.16 67.8 Favored Glycine 0 CA--C 1.531 1.036 0 O-C-N 124.527 1.142 . . . . 0.76000000000000001 110.989 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.65 -156.36 0.24 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.314 -0.995 . . . . 1.8 108.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.35 18.84 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.51 1.131 . . . . 1.04 109.279 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.74 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.2 mt-10 -155.85 135.05 12.19 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.119 . . . . 1.98 110.241 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.5 m -41.67 124.83 2.62 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 0.78000000000000003 110.406 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.74 HG13 ' O ' ' A' ' 29' ' ' GLU . 17.5 m -139.35 154.8 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 0.93000000000000005 109.292 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.527 HG22 ' HB2' ' A' ' 73' ' ' CYS . 30.7 m -108.09 146.18 33.0 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 0.88 110.378 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -138.16 172.01 14.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.54 1.15 . . . . 0.79000000000000004 109.278 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HD3' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -162.01 101.11 1.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.468 1.105 . . . . 2.7599999999999998 109.279 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.802 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -59.98 133.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.457 1.098 . . . . 0.68000000000000005 109.344 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 68' ' ' ARG . 90.6 t -113.22 124.68 70.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 0.68000000000000005 109.296 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.638 ' CZ ' ' OD1' ' A' ' 58' ' ' ASP . 11.7 m-85 -75.83 166.35 23.65 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.446 1.092 . . . . 1.6100000000000001 111.025 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.408 ' O ' ' OE1' ' A' ' 38' ' ' GLU . 1.7 tm-20 -72.26 -8.01 52.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.143 . . . . 3.4199999999999999 110.308 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -95.69 10.13 37.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.524 1.14 . . . . 2.0299999999999998 109.251 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 80.78 8.47 1.21 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 4.9800000000000004 109.294 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -79.77 166.71 21.48 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.514 1.134 . . . . 1.96 110.429 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.409 ' CD ' HG22 ' A' ' 36' ' ' VAL . 2.4 mt-10 -131.93 153.11 50.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.516 1.135 . . . . 3.25 110.308 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 35' ' ' VAL . . . -99.38 33.31 6.28 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.463 1.102 . . . . 3.3900000000000001 110.966 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 46' ' ' TYR . 0.5 OUTLIER 60.35 151.8 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.51 0.77 . . . . 2.52 109.327 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 73' ' ' CYS . 0.0 OUTLIER -85.26 141.54 30.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.521 1.138 . . . . 2.4500000000000002 108.253 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.773 ' HD2' HG12 ' A' ' 56' ' ' VAL . 27.7 m-85 -150.29 135.71 18.07 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.49 1.118 . . . . 2.4199999999999999 110.995 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.46 141.73 28.41 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 0.77000000000000002 109.277 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' HB ' ' A' ' 54' ' ' THR . 44.2 t -137.15 134.06 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.134 . . . . 0.63 109.321 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -71.83 166.44 40.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 0.63 109.325 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.02 113.96 3.91 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.503 1.791 . . . . 0.72999999999999998 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.72 8.57 54.25 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.512 1.133 . . . . 0.79000000000000004 111.024 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.12 161.85 17.83 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.539 0.788 . . . . 2.4700000000000002 110.324 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.798 HG22 ' HG2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -128.7 148.32 33.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.75 109.299 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.657 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -150.38 136.29 18.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 0.92000000000000004 110.399 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.51 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.4 m -74.75 138.4 42.68 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.523 1.139 . . . . 1.1000000000000001 110.43 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.773 HG12 ' HD2' ' A' ' 46' ' ' TYR . 10.5 m -110.45 -51.28 6.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.501 1.125 . . . . 2.2400000000000002 109.323 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.633 ' HA2' ' CD2' ' A' ' 20' ' ' TYR . . . 133.09 117.4 1.82 Allowed Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.513 1.133 . . . . 3.0800000000000001 110.993 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.638 ' OD1' ' CZ ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 162.6 130.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.528 0.781 . . . . 6.9400000000000004 109.276 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -144.75 116.38 0.93 Allowed Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.49 1.119 . . . . 1.3899999999999999 110.942 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.726 ' O ' ' CG ' ' A' ' 60' ' ' TYR . 0.5 OUTLIER -78.99 50.38 1.02 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.474 0.749 . . . . 2.0299999999999998 111.03 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.876 HG23 ' HB2' ' A' ' 18' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 2.9399999999999999 109.34 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.475 ' C ' ' CD2' ' A' ' 66' ' ' HIS . . . . . . . . 0 CA--C 1.53 0.993 0 N-CA-C 110.95 -0.86 . . . . 1.3300000000000001 110.95 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.565 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -131.79 135.43 46.76 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.503 0.766 . . . . 1.1499999999999999 109.567 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.71 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -38.82 128.95 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.547 1.154 . . . . 0.94999999999999996 109.277 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' A' ' 36' ' ' VAL . 2.1 ttt180 -77.34 -49.27 15.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 5.9400000000000004 110.333 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 13.0 p90 -176.01 173.48 2.25 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.535 1.147 . . . . 1.3300000000000001 111.031 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.802 ' CD2' HG23 ' A' ' 35' ' ' VAL . 7.7 mt -96.24 135.98 37.33 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.499 1.124 . . . . 0.95999999999999996 109.277 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 6' ' ' GLU . . . -117.18 163.37 16.39 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.461 1.101 . . . . 1.1799999999999999 109.317 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HG3' ' CG ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -114.81 136.85 52.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.522 1.139 . . . . 3.1499999999999999 110.249 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 45' ' ' CYS . 1.4 t . . . . . 0 C--N 1.325 -0.47 0 O-C-N 124.497 1.123 . . . . 1.9399999999999999 108.263 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.678 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.305 0 N-CA-C 110.332 -0.248 . . . . 3.3399999999999999 110.332 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 139.52 24.41 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.531 1.806 . . . . 0.56000000000000005 111.013 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.493 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.83 164.07 1.0 Allowed Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.12 . . . . 0.56999999999999995 109.34 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.1 Cg_endo -75.02 172.13 16.97 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.424 1.749 . . . . 0.72999999999999998 111.009 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 95.6 p -83.33 8.49 13.42 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 2.3399999999999999 110.034 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 15.7 p -110.14 29.15 7.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.51 1.131 . . . . 1.0 108.315 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 83.1 t -145.18 114.94 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 0.60999999999999999 109.326 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.6 142.62 28.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.53 1.144 . . . . 1.3600000000000001 110.362 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.686 HD21 ' HB3' ' A' ' 67' ' ' ALA . 20.1 tp -85.47 157.95 20.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.52 1.138 . . . . 1.1200000000000001 109.29 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -148.97 76.06 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.6299999999999999 111.006 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.409 ' HA ' ' OG ' ' A' ' 21' ' ' SER . 28.6 tt0 -79.93 141.5 35.99 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.475 1.11 . . . . 1.8999999999999999 110.296 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' SER . . . . . 0.473 ' O ' ' CD1' ' A' ' 60' ' ' TYR . 81.4 p -115.35 -128.24 0.29 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 1.78 109.984 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.67 ' HA ' ' CD1' ' A' ' 60' ' ' TYR . 41.2 p-90 -94.07 -68.4 0.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.561 1.163 . . . . 5.3200000000000003 108.047 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.646 ' HB2' ' CE3' ' A' ' 18' ' ' TRP . 2.1 ttp180 -118.12 37.06 4.11 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.409 1.068 . . . . 9.1500000000000004 110.289 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -177.67 159.25 1.43 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 6.2400000000000002 110.977 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.597 ' CB ' ' HB2' ' A' ' 58' ' ' ASP . 40.4 m -131.77 166.25 21.96 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.464 1.102 . . . . 2.02 109.995 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.457 ' N ' ' O ' ' A' ' 15' ' ' TYR . 5.1 tt0 -138.85 140.83 38.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.466 1.104 . . . . 2.3199999999999998 110.311 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.07 123.26 47.5 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.534 1.147 . . . . 0.52000000000000002 109.339 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.604 ' HA ' HG23 ' A' ' 53' ' ' ILE . 1.7 t0 -100.17 120.28 39.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.499 1.124 . . . . 2.0800000000000001 109.303 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.705 ' HB2' HG12 ' A' ' 48' ' ' VAL . 20.2 t-20 -78.7 101.39 7.5 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.48 1.113 . . . . 0.79000000000000004 109.361 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.24 -0.52 76.86 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.493 1.121 . . . . 0.69999999999999996 110.991 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' CYS . . . . . 0.519 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -85.32 -158.66 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.295 -1.002 . . . . 1.5900000000000001 108.295 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.462 ' HA ' ' CB ' ' A' ' 50' ' ' PRO . . . -133.4 28.47 4.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 1.0900000000000001 109.264 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -154.04 150.35 28.14 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.424 1.077 . . . . 3.25 110.309 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.496 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.2 m -73.76 127.66 33.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.435 1.085 . . . . 0.93000000000000005 110.38 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.2 m -142.25 166.61 16.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 0.81999999999999995 109.301 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.829 HG22 ' SG ' ' A' ' 45' ' ' CYS . 23.3 m -116.12 138.65 51.07 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.114 . . . . 0.91000000000000003 110.372 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.704 HG23 HD22 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -141.97 172.5 9.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.521 1.138 . . . . 0.90000000000000002 109.267 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.753 ' HE2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -148.19 118.06 7.15 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.555 1.159 . . . . 2.4300000000000002 109.288 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.819 HG11 ' OD2' ' A' ' 58' ' ' ASP . 0.4 OUTLIER -58.77 146.9 8.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.527 1.142 . . . . 0.73999999999999999 109.308 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 42' ' ' GLU . 73.4 t -126.79 123.22 62.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.558 1.161 . . . . 0.66000000000000003 109.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 89.5 m-85 -74.29 163.0 28.34 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.467 1.105 . . . . 1.55 111.014 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.2 OUTLIER -62.52 -12.07 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.512 1.132 . . . . 3.5699999999999998 110.343 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.62 5.5 35.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.484 1.115 . . . . 1.8700000000000001 109.31 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.9 OUTLIER 80.08 -2.91 1.99 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.453 1.096 . . . . 4.21 109.275 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' THR . . . . . 0.404 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.2 p -80.11 172.81 13.28 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.516 1.135 . . . . 1.3 110.396 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' GLU . . . . . 0.634 ' HG2' HG22 ' A' ' 36' ' ' VAL . 6.8 mt-10 -140.94 159.73 41.59 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.424 1.078 . . . . 1.8600000000000001 110.303 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -89.79 -99.66 1.09 Allowed Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.563 1.164 . . . . 1.9099999999999999 110.972 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.579 HD23 ' O ' ' A' ' 43' ' ' GLY . 54.6 mt -141.24 145.1 35.15 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.513 0.772 . . . . 1.6200000000000001 109.324 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . 0.829 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.7 OUTLIER -81.05 131.54 35.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.544 1.153 . . . . 1.8 108.302 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.751 ' HB2' HG12 ' A' ' 56' ' ' VAL . 28.8 m-85 -138.92 145.34 39.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.102 . . . . 2.02 110.969 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.47 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -94.15 129.83 40.58 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.508 1.13 . . . . 0.56000000000000005 109.278 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.861 HG22 ' HB ' ' A' ' 54' ' ' THR . 50.9 t -124.79 144.93 33.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.489 1.118 . . . . 0.38 109.291 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ALA . . . . . 0.572 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -89.75 166.76 19.45 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.541 1.151 . . . . 0.72999999999999998 109.315 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.572 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 123.18 7.7 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.504 1.792 . . . . 1.05 111.013 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.01 21.74 41.16 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 124.527 1.142 . . . . 1.1899999999999999 110.994 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.943 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -134.2 169.81 16.62 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.518 0.775 . . . . 2.8900000000000001 110.305 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.943 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -136.74 138.13 46.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 1.1000000000000001 109.268 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.861 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -138.11 140.91 40.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.478 1.111 . . . . 0.94999999999999996 110.438 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' THR . . . . . 0.479 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.5 m -84.9 127.31 34.1 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.468 1.105 . . . . 1.49 110.387 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.751 HG12 ' HB2' ' A' ' 46' ' ' TYR . 3.9 m -101.75 -42.89 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.477 1.11 . . . . 2.6200000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.551 ' O ' ' CB ' ' A' ' 58' ' ' ASP . . . 138.79 159.4 8.03 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.553 1.158 . . . . 2.46 110.985 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.819 ' OD2' HG11 ' A' ' 35' ' ' VAL . 2.4 m-20 152.03 -171.2 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.46 0.741 . . . . 6.4900000000000002 109.291 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.553 ' HA2' ' O ' ' A' ' 18' ' ' TRP . . . 174.73 118.46 0.52 Allowed Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.495 1.122 . . . . 1.9099999999999999 111.008 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.67 ' CD1' ' HA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -101.9 11.75 38.08 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.507 0.769 . . . . 3.5299999999999998 111.057 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ILE . . . . . 0.675 ' H ' HD13 ' A' ' 61' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.325 -0.461 0 O-C-N 124.5 1.125 . . . . 3.0899999999999999 109.265 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' GLY . . . . . . . . 0 CA--C 1.53 0.969 0 N-CA-C 111.009 -0.836 . . . . 1.3400000000000001 111.009 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.48 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.3 m170 -126.68 131.61 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 0.735 . . . . 2.0600000000000001 109.634 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.686 ' HB3' HD21 ' A' ' 14' ' ' LEU . . . -38.47 119.78 0.85 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 0.73999999999999999 109.284 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 38' ' ' GLU . 7.6 ttp85 -78.69 -44.27 24.0 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 5.1799999999999997 110.308 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 69' ' ' TYR . 7.8 p90 -176.43 167.88 2.76 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.517 1.135 . . . . 1.0 111.0 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.769 HD23 ' HA ' ' A' ' 35' ' ' VAL . 14.4 mt -101.2 147.29 26.44 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.533 1.146 . . . . 1.6100000000000001 109.329 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.753 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . . . -131.33 149.04 52.72 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.524 1.14 . . . . 0.56999999999999995 109.267 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -88.72 150.73 22.83 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 1.108 . . . . 3.71 110.277 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.5 m . . . . . 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 2.3100000000000001 108.301 -179.989 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.427 ' O ' ' N ' ' A' ' 3' ' ' THR . 10.3 t0 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.313 -0.625 . . . . 14.210000000000001 109.313 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.509 HG22 ' N ' ' A' ' 3' ' ' THR . 5.9 m 44.22 -96.21 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.467 1.104 . . . . 14.390000000000001 110.393 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.509 ' N ' HG22 ' A' ' 2' ' ' THR . 0.9 OUTLIER -117.69 129.13 55.54 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.489 1.118 . . . . 13.029999999999999 110.391 -179.962 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.9 p -148.18 136.87 15.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 7.7800000000000002 109.327 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.53 ' O ' ' CB ' ' A' ' 6' ' ' GLU . 1.4 m -54.79 -93.21 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.462 1.101 . . . . 3.3100000000000001 109.985 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.53 ' CB ' ' O ' ' A' ' 5' ' ' SER . 4.7 tt0 88.23 142.69 0.05 OUTLIER Pre-proline 0 C--N 1.325 -0.487 0 O-C-N 124.491 1.12 . . . . 3.7400000000000002 110.322 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.467 ' HD2' ' CG ' ' A' ' 6' ' ' GLU . 18.3 Cg_endo -74.99 144.8 30.71 Favored 'Trans proline' 0 C--N 1.361 1.189 0 O-C-N 124.507 1.793 . . . . 0.83999999999999997 111.008 179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.712 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -61.18 173.21 0.75 Allowed Pre-proline 0 C--N 1.326 -0.428 0 O-C-N 124.509 1.131 . . . . 0.66000000000000003 109.325 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.712 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -74.99 172.13 16.96 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.526 1.803 . . . . 0.93999999999999995 111.004 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.51 11.16 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.489 1.118 . . . . 2.1899999999999999 110.037 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.426 ' O ' ' N ' ' A' ' 26' ' ' GLY . 7.9 p -108.29 20.75 18.25 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.533 1.146 . . . . 0.97999999999999998 108.261 -179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.726 HG13 ' O ' ' A' ' 24' ' ' ASP . 43.9 t -138.28 131.46 40.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.565 1.166 . . . . 0.92000000000000004 109.27 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.473 ' CG2' ' N ' ' A' ' 14' ' ' LEU . 1.1 m -97.92 167.02 11.17 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.498 1.124 . . . . 2.23 110.389 179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 1.013 HD13 HD21 ' A' ' 70' ' ' LEU . 14.7 tp -123.76 130.91 53.37 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.69999999999999996 109.267 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -115.67 70.14 0.74 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 1.125 . . . . 1.29 110.985 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.647 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.9 tt0 -91.92 102.19 14.76 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.493 1.121 . . . . 1.3999999999999999 110.284 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.427 ' O ' ' CA ' ' A' ' 59' ' ' GLY . 10.5 p -106.68 -152.92 0.49 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.5 1.125 . . . . 1.9199999999999999 110.007 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.613 ' O ' HD12 ' A' ' 61' ' ' ILE . 55.7 p-90 -93.35 -27.54 16.71 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.496 1.122 . . . . 2.6299999999999999 107.981 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 2.1 tpt180 -77.2 -61.64 1.92 Allowed 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.488 1.118 . . . . 6.1900000000000004 110.337 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.475 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 2.6 p90 -159.25 177.09 11.4 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.125 . . . . 8.1199999999999992 110.998 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.498 ' O ' HG22 ' A' ' 55' ' ' THR . 0.1 OUTLIER -106.77 132.97 52.13 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.544 1.153 . . . . 2.1400000000000001 110.036 179.95 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.954 ' NE2' HG22 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -120.65 142.9 49.02 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.494 1.121 . . . . 2.6000000000000001 110.286 -179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.741 ' CB ' HG11 ' A' ' 56' ' ' VAL . . . -112.7 123.75 51.0 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.509 1.131 . . . . 0.59999999999999998 109.259 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.726 ' O ' HG13 ' A' ' 12' ' ' VAL . 39.6 t0 -107.47 126.15 52.15 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.469 1.106 . . . . 2.3100000000000001 109.332 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.534 ' CB ' HG12 ' A' ' 48' ' ' VAL . 56.5 t-20 -94.04 89.67 6.12 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.543 1.152 . . . . 0.67000000000000004 109.309 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.426 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -81.27 8.34 58.35 Favored Glycine 0 CA--C 1.531 1.04 0 O-C-N 124.525 1.14 . . . . 1.02 110.981 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.32 -179.99 7.32 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.301 -1.0 . . . . 1.8 108.301 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.444 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -115.49 21.25 14.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.516 1.135 . . . . 1.1299999999999999 109.294 -179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.474 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.5 mt-10 -154.02 137.99 16.34 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.464 1.102 . . . . 2.1299999999999999 110.301 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.417 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.8 m -51.72 130.3 28.25 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.533 1.146 . . . . 0.92000000000000004 110.455 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 29' ' ' GLU . 20.9 m -140.29 153.65 22.22 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 0.68000000000000005 109.287 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.82 HG22 ' SG ' ' A' ' 45' ' ' CYS . 54.8 m -113.15 133.13 55.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.56 1.163 . . . . 0.81000000000000005 110.397 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 71' ' ' ALA . 1.4 m -135.24 179.05 4.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.72999999999999998 109.275 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.554 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 13.6 pttm -159.7 108.88 1.81 Allowed 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.544 1.152 . . . . 2.5699999999999998 109.253 -179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 1.048 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.59 114.59 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 O-C-N 124.473 1.108 . . . . 0.52000000000000002 109.311 179.982 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.785 HG22 ' HG2' ' A' ' 42' ' ' GLU . 19.4 t -97.33 121.18 47.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 O-C-N 124.487 1.117 . . . . 0.73999999999999999 109.289 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -78.89 178.62 7.83 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.489 1.118 . . . . 0.93000000000000005 111.021 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.481 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 0.4 OUTLIER -84.61 -9.77 57.97 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.487 1.117 . . . . 3.2000000000000002 110.273 -179.986 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.489 ' HB2' ' CG2' ' A' ' 41' ' ' THR . 0.0 OUTLIER -81.59 0.93 36.12 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.546 1.154 . . . . 2.0800000000000001 109.299 179.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.488 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 81.52 31.0 0.13 Allowed 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.541 1.15 . . . . 3.6800000000000002 109.317 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.489 ' CG2' ' HB2' ' A' ' 39' ' ' ASP . 0.2 OUTLIER -124.44 174.28 7.88 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.46 1.1 . . . . 2.04 110.392 -179.978 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.785 ' HG2' HG22 ' A' ' 36' ' ' VAL . 1.7 mp0 -135.84 151.24 49.85 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.511 1.132 . . . . 2.6800000000000002 110.3 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.601 ' O ' ' CE2' ' A' ' 46' ' ' TYR . . . -87.78 46.51 3.45 Favored Glycine 0 CA--C 1.53 0.991 0 O-C-N 124.55 1.156 . . . . 3.2400000000000002 111.019 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 61.98 154.62 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.481 0.754 . . . . 2.23 109.301 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.82 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.8 OUTLIER -91.1 123.07 34.28 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.481 1.113 . . . . 1.99 108.298 -179.959 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CE2' ' O ' ' A' ' 43' ' ' GLY . 25.8 m-85 -124.93 137.59 54.26 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.48 1.112 . . . . 2.3900000000000001 110.971 -179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -93.85 130.21 39.98 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.488 1.117 . . . . 0.70999999999999996 109.277 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.534 HG12 ' CB ' ' A' ' 25' ' ' ASN . 40.6 t -126.81 138.02 56.08 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 O-C-N 124.476 1.11 . . . . 0.56999999999999995 109.285 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.733 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -81.07 172.9 8.65 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.49 1.119 . . . . 0.90000000000000002 109.291 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.733 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.08 99.32 1.24 Allowed 'Trans proline' 0 C--N 1.36 1.178 0 O-C-N 124.522 1.801 . . . . 0.79000000000000004 110.979 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 111.3 30.13 3.22 Favored Glycine 0 CA--C 1.53 1.001 0 O-C-N 124.496 1.122 . . . . 1.1499999999999999 110.982 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.973 ' O ' HD13 ' A' ' 53' ' ' ILE . 34.4 tt0 -125.49 153.29 43.78 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.465 0.744 . . . . 3.4199999999999999 110.327 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.973 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -139.33 120.77 15.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 O-C-N 124.51 1.131 . . . . 1.3400000000000001 109.333 179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.513 ' N ' HE22 ' A' ' 22' ' ' GLN . 0.7 OUTLIER -143.04 154.66 44.2 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.451 1.094 . . . . 1.52 110.415 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -61.88 146.68 49.05 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.526 1.142 . . . . 1.2 110.398 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.741 HG11 ' CB ' ' A' ' 23' ' ' ALA . 29.2 m -139.33 11.12 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.52 1.137 . . . . 2.5699999999999998 109.293 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 170.38 -169.58 42.39 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.457 1.098 . . . . 2.3799999999999999 110.947 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.446 ' C ' ' HA ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -104.42 -170.73 1.81 Allowed 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.471 0.748 . . . . 5.8499999999999996 109.299 179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.427 ' CA ' ' O ' ' A' ' 17' ' ' SER . . . -88.27 175.05 44.2 Favored Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.507 1.129 . . . . 1.3400000000000001 110.969 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.427 ' HB2' ' ND1' ' A' ' 66' ' ' HIS . 0.6 OUTLIER -94.2 36.04 1.15 Allowed 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.474 0.75 . . . . 2.27 111.022 179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.613 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.18 -8.42 11.59 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.439 1.087 . . . . 2.6899999999999999 109.283 -179.987 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 116.42 4.72 17.48 Favored Glycine 0 CA--C 1.529 0.959 0 O-C-N 124.53 1.144 . . . . 2.29 111.02 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.3 m -59.3 -98.57 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.483 0.755 . . . . 4.2000000000000002 109.987 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.415 ' O ' ' OD1' ' A' ' 39' ' ' ASP . 0.4 OUTLIER -91.59 33.11 1.03 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.466 1.104 . . . . 1.97 109.63 179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 85.97 -147.35 21.78 Favored Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.518 1.137 . . . . 1.1799999999999999 111.017 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.427 ' ND1' ' HB2' ' A' ' 60' ' ' TYR . 5.3 m-70 -125.15 116.28 21.79 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.5 0.765 . . . . 1.26 109.598 -179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.647 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -40.6 118.63 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.528 1.142 . . . . 0.60999999999999999 109.312 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.49 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -78.01 -45.39 23.85 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 5.9900000000000002 110.269 -179.977 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 68' ' ' ARG . 5.2 p90 177.21 166.94 0.58 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 1.4199999999999999 111.002 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 1.048 ' CD2' HG23 ' A' ' 35' ' ' VAL . 10.9 mt -85.06 136.46 33.56 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.548 1.155 . . . . 1.1799999999999999 109.319 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.554 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.6 138.05 51.72 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.542 1.151 . . . . 0.57999999999999996 109.309 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.452 ' N ' ' O ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -81.29 147.19 30.03 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.474 1.109 . . . . 3.77 110.306 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.12 -4.33 49.82 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.484 1.115 . . . . 2.5099999999999998 108.292 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 14.3 mt . . . . . 0 C--O 1.25 1.103 0 CA-C-O 116.997 -1.477 . . . . 5.9800000000000004 109.276 -179.977 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.429 ' O ' ' CB ' ' A' ' 2' ' ' THR . 9.9 p-10 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.312 -0.625 . . . . 13.43 109.312 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.429 ' CB ' ' O ' ' A' ' 1' ' ' ASP . 0.9 OUTLIER 171.51 -34.47 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.51 1.131 . . . . 10.16 110.378 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.5 p -42.39 121.32 1.9 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.551 1.157 . . . . 7.04 110.401 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 18.9 m 40.06 40.71 0.26 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.46 1.1 . . . . 7.9400000000000004 109.28 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -177.2 -156.33 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.428 1.08 . . . . 3.3199999999999998 110.024 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.401 ' O ' ' N ' ' A' ' 72' ' ' ARG . 0.0 OUTLIER -170.5 141.97 1.66 Allowed Pre-proline 0 C--N 1.326 -0.451 0 O-C-N 124.493 1.121 . . . . 3.2599999999999998 110.299 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -74.99 149.41 36.71 Favored 'Trans proline' 0 C--N 1.36 1.136 0 O-C-N 124.49 1.784 . . . . 1.1799999999999999 110.954 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.555 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -84.77 166.56 31.42 Favored Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.512 1.133 . . . . 0.69999999999999996 109.316 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.01 173.01 15.26 Favored 'Trans proline' 0 C--N 1.36 1.166 0 O-C-N 124.473 1.775 . . . . 0.93000000000000005 110.977 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.1 9.74 29.7 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.539 1.149 . . . . 3.3599999999999999 110.0 179.98 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HG2' ' A' ' 9' ' ' PRO . 11.8 p -91.05 -36.8 13.83 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.473 1.108 . . . . 2.0899999999999999 108.312 179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 33' ' ' VAL . 84.5 t -79.08 115.51 21.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.527 1.142 . . . . 0.63 109.29 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.414 ' OG1' ' OD1' ' A' ' 24' ' ' ASP . 0.0 OUTLIER -83.59 158.12 22.04 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.499 1.124 . . . . 0.97999999999999998 110.404 -179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.716 HD13 HD21 ' A' ' 70' ' ' LEU . 11.4 tp -113.13 112.22 23.44 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.48 1.113 . . . . 0.68999999999999995 109.292 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.483 ' HB3' ' CB ' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -96.19 59.22 1.9 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.518 1.136 . . . . 1.9099999999999999 110.963 -179.961 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.454 ' HA ' ' HA ' ' A' ' 21' ' ' SER . 6.1 tt0 -78.23 117.83 19.87 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.467 1.104 . . . . 1.52 110.26 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.531 ' OG ' ' O ' ' A' ' 20' ' ' TYR . 6.4 p -107.88 -149.36 0.43 Allowed 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.557 1.16 . . . . 1.1899999999999999 110.001 -179.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.653 ' CE3' ' N ' ' A' ' 19' ' ' ARG . 24.3 p-90 -106.68 -42.81 4.87 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.499 1.124 . . . . 2.25 108.03 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.653 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -78.31 -33.25 49.42 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 8.1199999999999992 110.339 179.944 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.65 ' C ' ' CD1' ' A' ' 20' ' ' TYR . 0.8 OUTLIER -167.4 160.08 13.0 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.518 1.136 . . . . 8.4299999999999997 110.979 -179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.594 ' O ' HG22 ' A' ' 55' ' ' THR . 5.6 m -112.22 144.22 41.99 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.511 1.132 . . . . 2.6200000000000001 110.003 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 1.7 tt0 -126.77 172.75 10.09 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.493 1.12 . . . . 1.8100000000000001 110.307 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -137.41 125.15 22.4 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.56 1.163 . . . . 0.60999999999999999 109.273 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.524 ' O ' HG13 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -97.89 137.34 36.88 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.479 1.112 . . . . 2.5 109.264 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.48 ' HB2' ' CG1' ' A' ' 48' ' ' VAL . 34.9 t-20 -95.69 81.97 3.55 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.78000000000000003 109.252 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -87.84 20.52 27.93 Favored Glycine 0 CA--C 1.53 1.011 0 O-C-N 124.502 1.126 . . . . 1.1599999999999999 110.989 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.406 ' O ' ' C ' ' A' ' 28' ' ' ALA . 0.0 OUTLIER -94.05 10.11 34.95 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 108.28 -1.007 . . . . 3.0099999999999998 108.28 179.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.466 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.88 32.68 0.11 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.448 1.092 . . . . 2.0 109.327 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.461 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -163.03 138.68 6.86 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.52 1.138 . . . . 2.0299999999999998 110.299 -179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.8 m -54.62 118.95 4.61 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.477 1.111 . . . . 0.96999999999999997 110.423 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.461 HG13 ' O ' ' A' ' 29' ' ' GLU . 34.2 m -143.88 173.4 5.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.485 1.116 . . . . 0.57999999999999996 109.281 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.424 HG23 ' C ' ' A' ' 46' ' ' TYR . 60.0 m -124.56 141.97 51.69 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 0.71999999999999997 110.424 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.823 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -141.91 175.34 5.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.448 1.092 . . . . 0.63 109.275 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.992 ' CG ' ' HB3' ' A' ' 71' ' ' ALA . 16.0 ptmt -156.6 112.01 2.9 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 3.0800000000000001 109.309 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.662 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.5 OUTLIER -56.48 132.4 20.51 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.516 1.135 . . . . 0.53000000000000003 109.26 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.874 HG11 ' CZ ' ' A' ' 69' ' ' TYR . 78.6 t -116.96 118.64 59.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.5 1.125 . . . . 0.77000000000000002 109.328 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.607 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 74.1 m-85 -76.44 166.33 23.57 Favored 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.505 1.128 . . . . 0.90000000000000002 111.018 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.486 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -65.91 -9.77 32.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.53 1.144 . . . . 3.0899999999999999 110.312 179.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -90.47 19.09 5.51 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.526 1.142 . . . . 2.6600000000000001 109.344 179.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 61.72 13.72 5.56 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.471 1.107 . . . . 4.2300000000000004 109.291 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.42 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -93.31 161.94 14.2 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.522 1.139 . . . . 1.0900000000000001 110.401 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.568 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.1 mt-10 -135.52 146.08 47.71 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.509 1.13 . . . . 2.8100000000000001 110.334 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.71 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -73.14 -92.63 0.11 Allowed Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.475 1.109 . . . . 1.8400000000000001 110.967 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.71 HD23 ' O ' ' A' ' 43' ' ' GLY . 42.4 mt -153.31 144.45 23.0 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.446 0.733 . . . . 1.25 109.306 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.9 m -75.75 105.5 6.82 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.566 1.166 . . . . 2.2799999999999998 108.327 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.424 ' C ' HG23 ' A' ' 32' ' ' THR . 8.1 m-30 -112.97 142.12 46.02 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.518 1.136 . . . . 1.99 110.979 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -97.22 122.8 40.65 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.471 1.107 . . . . 0.42999999999999999 109.31 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.524 HG22 ' HB ' ' A' ' 54' ' ' THR . 74.8 t -113.71 140.68 32.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.513 1.133 . . . . 0.34999999999999998 109.281 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.828 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.8 177.54 2.93 Favored Pre-proline 0 C--N 1.325 -0.49 0 O-C-N 124.515 1.134 . . . . 0.56000000000000005 109.314 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.828 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.4 Cg_endo -74.99 108.49 2.73 Favored 'Trans proline' 0 C--N 1.36 1.154 0 O-C-N 124.486 1.782 . . . . 1.02 111.002 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.02 39.66 6.41 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.441 1.088 . . . . 0.73999999999999999 111.027 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.894 ' C ' HD13 ' A' ' 53' ' ' ILE . 12.1 tt0 -134.98 157.84 45.88 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.462 0.742 . . . . 2.2200000000000002 110.34 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.894 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -130.22 137.22 56.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.523 1.139 . . . . 1.0700000000000001 109.286 -179.974 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.524 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -143.68 143.64 31.52 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.494 1.121 . . . . 0.79000000000000004 110.445 -179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.594 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -69.2 131.96 45.75 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.489 1.118 . . . . 1.2 110.422 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.511 HG23 ' HB ' ' A' ' 35' ' ' VAL . 12.2 m -119.09 -10.13 11.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.476 1.11 . . . . 1.98 109.253 -179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -171.41 -172.88 37.94 Favored Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.501 1.125 . . . . 2.4199999999999999 111.026 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.503 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.5 m-20 -90.11 -166.32 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.504 0.767 . . . . 6.2699999999999996 109.279 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.415 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -86.56 170.47 42.38 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.5 1.125 . . . . 1.6399999999999999 111.021 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.566 ' C ' ' CD1' ' A' ' 60' ' ' TYR . 0.0 OUTLIER -92.6 40.99 1.06 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.517 0.775 . . . . 2.4199999999999999 111.012 179.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.637 HG23 ' O ' ' A' ' 18' ' ' TRP . 0.1 OUTLIER -78.2 -4.5 6.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.461 1.101 . . . . 2.75 109.324 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 113.13 5.06 23.63 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.521 1.138 . . . . 2.48 111.029 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.444 ' OG ' ' N ' ' A' ' 64' ' ' HIS . 94.2 p -59.18 -97.55 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.465 0.744 . . . . 4.6600000000000001 110.023 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.607 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.7 OUTLIER -90.58 25.59 2.26 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.53 1.144 . . . . 2.0600000000000001 109.637 179.933 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 92.27 -156.23 23.33 Favored Glycine 0 CA--C 1.531 1.049 0 O-C-N 124.532 1.145 . . . . 1.1499999999999999 110.998 179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.516 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.0 OUTLIER -124.52 119.16 28.32 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.541 0.789 . . . . 1.26 109.56 -179.976 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.504 ' HB1' HG22 ' A' ' 35' ' ' VAL . . . -45.2 108.79 0.13 Allowed 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.491 1.119 . . . . 1.01 109.316 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -77.51 -31.2 53.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.489 1.118 . . . . 4.5700000000000003 110.314 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.874 ' CZ ' HG11 ' A' ' 36' ' ' VAL . 15.7 p90 -173.93 175.69 2.76 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.503 1.127 . . . . 1.1299999999999999 110.973 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.716 HD21 HD13 ' A' ' 14' ' ' LEU . 51.7 mt -106.41 140.2 39.7 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.466 1.104 . . . . 1.1000000000000001 109.294 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.992 ' HB3' ' CG ' ' A' ' 34' ' ' LYS . . . -107.78 142.79 37.27 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.538 1.149 . . . . 0.54000000000000004 109.342 179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -87.63 139.92 30.05 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 3.7999999999999998 110.279 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -127.85 123.71 35.77 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.472 1.108 . . . . 2.75 108.3 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.001 -1.476 . . . . 5.1299999999999999 109.285 -179.991 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.494 ' O ' ' C ' ' A' ' 2' ' ' THR . 9.2 t0 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.32 -0.622 . . . . 13.56 109.32 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.58 HG23 ' H ' ' A' ' 3' ' ' THR . 0.0 OUTLIER 29.96 -96.8 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.44 1.088 . . . . 9.4800000000000004 110.443 179.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.58 ' H ' HG23 ' A' ' 2' ' ' THR . 9.4 t -160.48 156.47 26.01 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.535 1.147 . . . . 8.2100000000000009 110.401 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.445 HG23 HG23 ' A' ' 3' ' ' THR . 25.5 t 68.07 83.44 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.492 1.12 . . . . 7.96 109.336 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -79.33 -77.65 0.17 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.537 1.148 . . . . 3.1800000000000002 110.015 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 175.18 95.59 0.08 OUTLIER Pre-proline 0 C--N 1.325 -0.491 0 O-C-N 124.502 1.126 . . . . 3.9900000000000002 110.29 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -75.01 142.65 28.09 Favored 'Trans proline' 0 C--N 1.36 1.169 0 O-C-N 124.517 1.798 . . . . 0.55000000000000004 111.03 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.32 158.48 56.69 Favored Pre-proline 0 C--N 1.325 -0.498 0 O-C-N 124.499 1.125 . . . . 0.59999999999999998 109.3 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -75.05 171.36 18.47 Favored 'Trans proline' 0 C--N 1.36 1.156 0 O-C-N 124.472 1.775 . . . . 0.71999999999999997 110.969 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 58.8 m -85.41 9.13 16.49 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.491 1.12 . . . . 2.2200000000000002 109.982 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 19.8 p -104.74 23.19 13.81 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.509 1.131 . . . . 1.01 108.298 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.449 HG13 ' O ' ' A' ' 24' ' ' ASP . 84.7 t -146.03 116.02 1.61 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.461 1.1 . . . . 0.60999999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.435 ' N ' ' O ' ' A' ' 24' ' ' ASP . 0.2 OUTLIER -81.24 161.81 23.8 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.486 1.116 . . . . 0.98999999999999999 110.44 179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.576 HD13 HG23 ' A' ' 35' ' ' VAL . 16.1 tp -118.63 106.08 12.25 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.481 1.113 . . . . 0.60999999999999999 109.292 -179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.725 ' HD2' HG21 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -87.24 61.72 6.85 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.475 1.109 . . . . 1.6299999999999999 110.98 -179.96 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.655 ' CD ' ' HB3' ' A' ' 67' ' ' ALA . 35.4 tt0 -78.24 96.84 5.34 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.572 1.17 . . . . 1.3799999999999999 110.327 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -89.34 -163.0 0.93 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.491 1.12 . . . . 2.3199999999999998 109.996 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.69 ' HB2' HG21 ' A' ' 61' ' ' ILE . 66.1 p-90 -99.14 -49.79 4.37 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.479 1.112 . . . . 2.8100000000000001 108.045 179.939 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.577 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -75.03 -21.11 59.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.473 1.108 . . . . 6.8300000000000001 110.284 -179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.448 ' O ' ' CB ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -166.87 175.51 7.68 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.577 1.173 . . . . 5.5599999999999996 110.976 -179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.552 ' O ' HG22 ' A' ' 55' ' ' THR . 6.0 m -141.58 138.5 32.69 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.506 1.129 . . . . 2.6800000000000002 109.968 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.517 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 0.0 OUTLIER -137.66 -179.97 6.07 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.57 1.169 . . . . 2.3300000000000001 110.284 179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -134.03 129.95 36.83 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.68999999999999995 109.33 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.634 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.1 OUTLIER -95.12 136.25 35.67 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.555 1.16 . . . . 4.6299999999999999 109.301 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.475 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.0 t-20 -96.49 87.22 4.35 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.448 1.093 . . . . 0.45000000000000001 109.301 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.44 13.04 53.58 Favored Glycine 0 CA--C 1.53 1.024 0 O-C-N 124.526 1.141 . . . . 0.56999999999999995 110.985 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -88.2 -155.64 0.33 Allowed 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.328 -0.99 . . . . 1.6000000000000001 108.328 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -135.59 20.98 3.34 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.488 1.117 . . . . 1.1399999999999999 109.313 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.408 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -155.95 152.26 27.99 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.5 1.125 . . . . 2.96 110.29 -179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.434 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.1 m -65.8 125.64 25.96 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.465 1.103 . . . . 0.71999999999999997 110.353 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 m -138.24 159.52 32.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.424 1.077 . . . . 0.52000000000000002 109.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.556 HG22 ' HB2' ' A' ' 73' ' ' CYS . 67.1 m -114.58 143.71 44.56 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.532 1.145 . . . . 0.65000000000000002 110.417 -179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.442 HG23 HD22 ' A' ' 70' ' ' LEU . 3.4 m -141.09 177.84 3.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 0.68000000000000005 109.285 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.617 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -154.96 105.53 2.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.51 1.131 . . . . 1.9099999999999999 109.291 179.976 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.727 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -53.7 116.01 0.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 0.67000000000000004 109.3 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.883 HG22 ' HG2' ' A' ' 42' ' ' GLU . 23.2 t -99.39 120.36 48.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 O-C-N 124.461 1.101 . . . . 0.51000000000000001 109.292 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.586 ' CG ' ' O ' ' A' ' 64' ' ' HIS . 96.4 m-85 -83.94 167.92 16.51 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.508 1.13 . . . . 1.0900000000000001 110.939 -179.964 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.501 ' CG ' ' HD3' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -58.47 -21.5 51.76 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.472 1.108 . . . . 3.98 110.286 179.986 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.441 ' N ' ' OD1' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -79.82 3.56 19.24 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.533 1.146 . . . . 2.29 109.313 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 75.22 3.06 4.02 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.485 1.116 . . . . 4.2199999999999998 109.281 179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.619 HG21 ' HE1' ' A' ' 64' ' ' HIS . 1.4 p -78.73 144.94 34.78 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 124.492 1.12 . . . . 0.87 110.404 -179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.883 ' HG2' HG22 ' A' ' 36' ' ' VAL . 0.4 OUTLIER -121.36 142.38 50.04 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.497 1.123 . . . . 2.48 110.299 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.704 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -60.88 -106.65 0.01 OUTLIER Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.484 1.115 . . . . 1.8300000000000001 110.961 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.704 HD23 ' O ' ' A' ' 43' ' ' GLY . 47.2 mt -153.02 140.15 19.36 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.514 0.773 . . . . 1.28 109.304 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 34.8 m -42.8 101.46 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.47 1.106 . . . . 1.8600000000000001 108.298 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.564 ' CD2' ' HA ' ' A' ' 56' ' ' VAL . 2.6 m-85 -108.98 111.91 23.83 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.46 1.1 . . . . 2.3999999999999999 111.031 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -88.83 128.84 35.66 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.52 1.138 . . . . 0.55000000000000004 109.332 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.663 HG22 ' HB ' ' A' ' 54' ' ' THR . 69.6 t -128.79 140.3 49.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.465 1.103 . . . . 0.33000000000000002 109.356 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.686 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.51 171.77 11.5 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.515 1.134 . . . . 0.46999999999999997 109.292 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.686 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.5 Cg_endo -74.97 102.52 1.6 Allowed 'Trans proline' 0 C--N 1.36 1.167 0 O-C-N 124.475 1.776 . . . . 0.66000000000000003 111.044 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 105.13 36.55 2.89 Favored Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.507 1.129 . . . . 0.66000000000000003 110.989 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.748 ' C ' HD13 ' A' ' 53' ' ' ILE . 0.5 OUTLIER -144.94 158.27 43.86 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.545 0.791 . . . . 2.2400000000000002 110.291 179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.748 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -126.68 141.75 45.17 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.444 1.09 . . . . 0.95999999999999996 109.326 179.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.663 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -146.45 141.31 27.0 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.476 1.11 . . . . 0.76000000000000001 110.376 -179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.552 HG22 ' O ' ' A' ' 21' ' ' SER . 0.2 OUTLIER -59.58 141.5 54.79 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.108 . . . . 1.25 110.408 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.564 ' HA ' ' CD2' ' A' ' 46' ' ' TYR . 15.3 m -129.59 1.21 2.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 O-C-N 124.473 1.108 . . . . 2.3700000000000001 109.311 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.436 ' O ' ' N ' ' A' ' 21' ' ' SER . . . 164.37 -173.48 40.34 Favored Glycine 0 CA--C 1.529 0.962 0 O-C-N 124.55 1.156 . . . . 2.2999999999999998 111.048 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.434 ' N ' ' OH ' ' A' ' 37' ' ' TYR . 7.9 m-20 -92.61 -173.58 3.4 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.521 0.777 . . . . 5.8700000000000001 109.305 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.514 ' O ' ' HB2' ' A' ' 63' ' ' SER . . . -83.68 -176.78 51.44 Favored Glycine 0 CA--C 1.53 0.98 0 O-C-N 124.551 1.157 . . . . 1.22 111.03 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.567 ' HB2' ' CD2' ' A' ' 66' ' ' HIS . 3.9 p90 -101.13 27.95 5.72 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.501 0.765 . . . . 2.6899999999999999 111.016 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.69 HG21 ' HB2' ' A' ' 18' ' ' TRP . 1.3 pp -93.36 51.48 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.512 1.132 . . . . 2.8100000000000001 109.317 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.428 ' O ' ' O ' ' A' ' 63' ' ' SER . . . 88.74 -1.3 83.49 Favored Glycine 0 CA--C 1.53 1.028 0 O-C-N 124.508 1.13 . . . . 2.2000000000000002 111.027 -179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.514 ' HB2' ' O ' ' A' ' 59' ' ' GLY . 1.1 m -60.4 -138.32 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.499 0.764 . . . . 5.4900000000000002 109.987 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.619 ' HE1' HG21 ' A' ' 41' ' ' THR . 1.0 OUTLIER -79.44 37.48 0.34 Allowed 'General case' 0 C--N 1.324 -0.531 0 O-C-N 124.544 1.152 . . . . 2.0699999999999998 109.615 179.981 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.454 ' H ' ' C ' ' A' ' 63' ' ' SER . . . 91.87 -161.69 27.11 Favored Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.49 1.119 . . . . 1.28 111.004 -179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.567 ' CD2' ' HB2' ' A' ' 60' ' ' TYR . 10.6 m170 -107.93 107.0 17.52 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.498 0.764 . . . . 2.4500000000000002 109.589 -179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.655 ' HB3' ' CD ' ' A' ' 16' ' ' GLN . . . -39.66 113.18 0.31 Allowed 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.493 1.12 . . . . 0.60999999999999999 109.28 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.502 ' HB3' ' CD2' ' A' ' 69' ' ' TYR . 0.0 OUTLIER -78.14 -38.34 43.95 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.49 1.119 . . . . 6.0899999999999999 110.317 179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.502 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 18.1 p90 179.53 -166.12 0.07 Allowed 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.492 1.12 . . . . 1.1299999999999999 111.02 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.727 HD23 ' HA ' ' A' ' 35' ' ' VAL . 70.9 mt -115.24 138.24 51.16 Favored 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.527 1.142 . . . . 1.26 109.32 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.617 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -116.42 139.4 50.48 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.499 1.124 . . . . 0.60999999999999999 109.291 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.8 147.3 51.96 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.536 1.147 . . . . 3.1699999999999999 110.344 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.556 ' HB2' HG22 ' A' ' 32' ' ' THR . 40.7 t -79.57 -102.06 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.461 1.101 . . . . 2.6600000000000001 108.307 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-O 116.974 -1.488 . . . . 7.21 109.261 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.309 -0.626 . . . . 14.43 109.309 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 46.3 p 40.48 75.17 0.09 Allowed 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.512 1.133 . . . . 11.359999999999999 110.44 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.549 HG23 ' O ' ' A' ' 3' ' ' THR . 13.5 t -115.11 49.0 1.09 Allowed 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.446 1.091 . . . . 9.0 110.361 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 9.9 m -123.72 108.32 20.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.528 1.143 . . . . 7.5599999999999996 109.278 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -124.01 -149.59 0.43 Allowed 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.506 1.129 . . . . 3.79 109.97 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.418 ' CG ' ' HB2' ' A' ' 72' ' ' ARG . 43.1 tp10 -153.63 102.11 2.54 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.509 1.131 . . . . 3.4199999999999999 110.282 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.0 139.6 24.46 Favored 'Trans proline' 0 C--N 1.361 1.186 0 O-C-N 124.524 1.802 . . . . 0.67000000000000004 110.998 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.622 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -57.29 168.45 0.95 Allowed Pre-proline 0 C--N 1.325 -0.473 0 O-C-N 124.511 1.132 . . . . 0.60999999999999999 109.313 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.622 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.3 Cg_endo -75.0 170.0 21.39 Favored 'Trans proline' 0 C--N 1.36 1.14 0 O-C-N 124.518 1.799 . . . . 0.80000000000000004 111.004 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.54 13.31 12.32 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.473 1.108 . . . . 2.2799999999999998 110.024 179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 25.2 p -112.65 21.46 15.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.492 1.12 . . . . 0.95999999999999996 108.294 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.592 HG22 ' HA ' ' A' ' 25' ' ' ASN . 3.1 t -139.5 123.04 18.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 O-C-N 124.517 1.136 . . . . 0.67000000000000004 109.28 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.49 154.31 19.21 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.436 1.085 . . . . 1.1000000000000001 110.409 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.966 HD13 HD21 ' A' ' 70' ' ' LEU . 6.1 tp -108.07 111.96 24.27 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.519 1.137 . . . . 0.54000000000000004 109.319 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.498 ' HB3' ' HB2' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -93.23 58.06 2.8 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.548 1.155 . . . . 1.51 110.97 179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.657 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 33.1 tt0 -74.48 98.43 3.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.52 1.138 . . . . 1.51 110.311 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.493 ' HG ' ' H ' ' A' ' 20' ' ' TYR . 0.9 OUTLIER -92.6 -160.84 0.78 Allowed 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.483 1.115 . . . . 1.22 109.998 -179.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.825 ' O ' HD11 ' A' ' 61' ' ' ILE . 29.8 p-90 -99.5 -46.48 5.46 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.502 1.126 . . . . 2.8900000000000001 107.97 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 3.5 ttp180 -71.67 -34.24 69.53 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.511 1.132 . . . . 5.7400000000000002 110.307 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.567 ' CD2' HG21 ' A' ' 55' ' ' THR . 0.1 OUTLIER -167.45 157.29 10.62 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.52 1.138 . . . . 6.0700000000000003 111.005 179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.51 ' CB ' ' O ' ' A' ' 58' ' ' ASP . 2.8 t -105.94 134.96 48.23 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.477 1.11 . . . . 1.9199999999999999 110.01 179.948 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.566 ' HA ' ' HA ' ' A' ' 55' ' ' THR . 9.5 mt-30 -125.74 172.15 10.04 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.507 1.129 . . . . 2.0800000000000001 110.259 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.795 ' HB2' HG11 ' A' ' 56' ' ' VAL . . . -134.76 129.23 34.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.523 1.14 . . . . 0.5 109.301 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' OD1' ' N ' ' A' ' 25' ' ' ASN . 2.8 t0 -102.65 133.46 47.62 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.471 1.107 . . . . 2.2000000000000002 109.288 -179.966 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.592 ' HA ' HG22 ' A' ' 12' ' ' VAL . 60.8 t-20 -93.67 93.77 8.21 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.489 1.118 . . . . 0.5 109.262 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -86.51 9.6 70.23 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.519 1.137 . . . . 0.60999999999999999 110.993 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.55 -167.71 1.94 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.295 -1.002 . . . . 1.6399999999999999 108.295 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.422 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -125.2 25.44 7.18 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.576 1.173 . . . . 1.1499999999999999 109.3 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.411 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 10.3 mt-10 -158.09 144.82 17.71 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.502 1.126 . . . . 2.2999999999999998 110.28 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.0 m -61.78 128.89 38.41 Favored 'General case' 0 C--N 1.326 -0.44 0 O-C-N 124.454 1.096 . . . . 0.73999999999999999 110.359 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 34.2 m -141.21 162.25 21.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.497 1.123 . . . . 0.52000000000000002 109.282 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.495 HG22 ' HB2' ' A' ' 73' ' ' CYS . 49.0 m -111.94 143.61 42.64 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.469 1.106 . . . . 0.54000000000000004 110.405 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.438 HG11 HG11 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -140.71 177.94 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.453 1.096 . . . . 0.54000000000000004 109.318 -179.975 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.7 pttt -160.67 110.48 1.73 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.55 1.156 . . . . 2.02 109.329 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.804 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -61.88 114.35 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.46 1.1 . . . . 0.71999999999999997 109.273 -179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.952 HG22 ' HG2' ' A' ' 42' ' ' GLU . 84.7 t -96.05 117.62 40.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.502 1.126 . . . . 0.5 109.286 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 25.2 m-85 -75.45 173.47 10.92 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.52 1.137 . . . . 1.72 111.048 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.432 ' HG2' ' CG ' ' A' ' 68' ' ' ARG . 1.8 mm-40 -81.16 -12.06 59.3 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.462 1.102 . . . . 3.6400000000000001 110.255 -179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.457 ' CG ' ' OG1' ' A' ' 41' ' ' THR . 5.2 p-10 -93.73 34.0 1.24 Allowed 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.464 1.102 . . . . 2.6499999999999999 109.303 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.44 ' O ' HG23 ' A' ' 41' ' ' THR . 1.7 m-20 46.96 67.38 0.8 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.512 1.133 . . . . 4.2599999999999998 109.306 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.457 ' OG1' ' CG ' ' A' ' 39' ' ' ASP . 1.0 OUTLIER -152.29 152.16 31.81 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.463 1.102 . . . . 0.92000000000000004 110.357 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.952 ' HG2' HG22 ' A' ' 36' ' ' VAL . 7.9 mt-10 -130.9 139.58 50.11 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.491 1.119 . . . . 2.0499999999999998 110.313 179.972 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.685 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -58.95 -103.94 0.01 OUTLIER Glycine 0 CA--C 1.53 0.984 0 O-C-N 124.537 1.148 . . . . 1.72 110.996 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.685 HD23 ' O ' ' A' ' 43' ' ' GLY . 45.1 mt -153.6 139.66 18.3 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.529 0.782 . . . . 1.3200000000000001 109.319 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 1.7 m -51.53 103.54 0.06 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.496 1.123 . . . . 1.6299999999999999 108.328 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.601 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 33.2 m-85 -112.05 122.87 48.96 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.52 1.137 . . . . 1.72 111.017 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -94.67 123.77 38.3 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.493 1.121 . . . . 0.5 109.301 179.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.572 HG12 ' HB2' ' A' ' 25' ' ' ASN . 68.2 t -122.36 138.34 52.85 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 O-C-N 124.499 1.124 . . . . 0.35999999999999999 109.318 179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.726 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.93 173.51 7.61 Favored Pre-proline 0 C--N 1.325 -0.461 0 O-C-N 124.52 1.137 . . . . 0.48999999999999999 109.35 -179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.726 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 97.74 1.1 Allowed 'Trans proline' 0 C--N 1.36 1.143 0 O-C-N 124.487 1.783 . . . . 0.65000000000000002 111.0 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 109.9 35.27 2.22 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.507 1.13 . . . . 0.80000000000000004 110.967 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.723 ' C ' HD13 ' A' ' 53' ' ' ILE . 3.2 mt-30 -140.05 159.48 42.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.511 0.771 . . . . 3.54 110.289 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.723 HD13 ' C ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -128.82 140.27 49.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 O-C-N 124.496 1.122 . . . . 0.98999999999999999 109.284 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.544 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.6 OUTLIER -148.05 147.76 29.93 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.556 1.16 . . . . 0.95999999999999996 110.418 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.567 HG21 ' CD2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -60.94 146.15 47.83 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.508 1.13 . . . . 1.6299999999999999 110.427 -179.999 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.795 HG11 ' HB2' ' A' ' 23' ' ' ALA . 29.5 m -132.64 -0.54 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.479 1.112 . . . . 2.6600000000000001 109.332 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 162.52 -169.46 37.8 Favored Glycine 0 CA--C 1.53 1.01 0 O-C-N 124.519 1.137 . . . . 2.25 111.014 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.51 ' O ' ' CB ' ' A' ' 21' ' ' SER . 4.4 m-20 -89.67 -164.63 1.18 Allowed 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.513 0.773 . . . . 5.6699999999999999 109.309 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.448 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -86.53 -169.06 45.54 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.514 1.134 . . . . 1.1399999999999999 111.007 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.546 ' CD2' HG23 ' A' ' 61' ' ' ILE . 18.5 p90 -90.86 -7.09 53.23 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 124.537 0.786 . . . . 1.9199999999999999 110.975 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.825 HD11 ' O ' ' A' ' 18' ' ' TRP . 0.3 OUTLIER -101.82 9.35 8.65 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 O-C-N 124.552 1.158 . . . . 2.9500000000000002 109.32 179.964 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -81.28 -163.64 31.16 Favored Glycine 0 CA--C 1.531 1.046 0 O-C-N 124.493 1.121 . . . . 3.1099999999999999 111.017 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -92.2 -15.14 27.96 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.54 0.788 . . . . 4.4400000000000004 109.996 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.602 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -86.29 8.76 20.09 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.489 1.118 . . . . 2.6200000000000001 109.574 179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 75.0 -136.72 21.03 Favored Glycine 0 CA--C 1.53 1.016 0 O-C-N 124.534 1.146 . . . . 0.83999999999999997 111.011 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.583 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -118.82 131.29 56.09 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.535 0.785 . . . . 1.22 109.644 179.961 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.657 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -46.33 122.59 4.13 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.493 1.121 . . . . 0.67000000000000004 109.309 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -77.9 -47.38 18.82 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.575 1.172 . . . . 5.5 110.287 -179.959 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.537 ' CE2' ' HD2' ' A' ' 68' ' ' ARG . 6.2 p90 -174.85 -177.5 1.13 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.496 1.123 . . . . 1.0600000000000001 110.988 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.966 HD21 HD13 ' A' ' 14' ' ' LEU . 7.9 mt -105.69 135.05 47.8 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.551 1.157 . . . . 1.51 109.28 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.414 ' HA ' ' O ' ' A' ' 6' ' ' GLU . . . -123.19 148.52 45.71 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.507 1.129 . . . . 0.54000000000000004 109.295 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.418 ' HB2' ' CG ' ' A' ' 6' ' ' GLU . 3.6 mtt180 -81.3 154.49 26.51 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.511 1.132 . . . . 4.3300000000000001 110.301 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' A' ' 32' ' ' THR . 38.1 t -78.76 -117.47 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.499 1.124 . . . . 2.6299999999999999 108.324 179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.1 0 CA-C-O 117.076 -1.44 . . . . 6.6600000000000001 109.314 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.309 -0.626 . . . . 19.210000000000001 109.309 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.5 m -151.13 63.1 0.9 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.488 1.117 . . . . 17.210000000000001 110.401 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.4 p -94.27 53.37 1.71 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.494 1.122 . . . . 12.32 110.397 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 8.9 p -148.68 156.45 8.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 O-C-N 124.481 1.113 . . . . 10.23 109.299 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.41 ' O ' ' O ' ' A' ' 72' ' ' ARG . 28.6 t -156.95 -97.03 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.476 1.11 . . . . 4.4100000000000001 110.032 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 0.6 OUTLIER 79.13 138.99 0.06 OUTLIER Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.521 1.138 . . . . 3.0699999999999998 110.311 179.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 148.88 35.75 Favored 'Trans proline' 0 C--N 1.359 1.115 0 O-C-N 124.552 1.817 . . . . 0.76000000000000001 110.978 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.469 ' N ' ' O ' ' A' ' 70' ' ' LEU . . . -76.07 150.35 83.21 Favored Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.474 1.109 . . . . 1.28 109.325 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.425 ' HD3' ' NE ' ' A' ' 72' ' ' ARG . 18.2 Cg_endo -75.01 -176.1 2.71 Favored 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.435 1.755 . . . . 1.5800000000000001 110.985 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.52 6.34 20.81 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.456 1.098 . . . . 1.8300000000000001 109.988 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.448 ' O ' ' N ' ' A' ' 26' ' ' GLY . 2.0 p -96.42 20.09 11.1 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.533 1.146 . . . . 1.1399999999999999 108.327 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.576 HG21 ' NH1' ' A' ' 72' ' ' ARG . 70.0 t -149.47 121.83 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 O-C-N 124.517 1.135 . . . . 0.63 109.257 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.47 136.75 36.54 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.531 1.145 . . . . 1.0700000000000001 110.385 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.483 ' HA ' HD11 ' A' ' 70' ' ' LEU . 32.5 tp -89.98 105.53 17.87 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.545 1.153 . . . . 0.62 109.311 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.545 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -96.44 65.44 2.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.446 1.091 . . . . 1.27 110.958 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.674 ' OE1' ' HB3' ' A' ' 67' ' ' ALA . 17.4 tt0 -77.2 120.63 22.53 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.535 1.147 . . . . 1.55 110.278 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.592 ' O ' ' CD2' ' A' ' 60' ' ' TYR . 6.4 p -87.77 -144.22 0.13 Allowed 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.476 1.11 . . . . 1.3700000000000001 109.976 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.983 ' O ' HD12 ' A' ' 61' ' ' ILE . 32.4 p-90 -101.74 -54.76 2.66 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 108.012 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.637 ' HB3' ' CE3' ' A' ' 18' ' ' TRP . 2.8 ptt180 -107.67 14.75 25.32 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.489 1.118 . . . . 5.5099999999999998 110.299 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.616 ' CD1' ' HA2' ' A' ' 57' ' ' GLY . 0.2 OUTLIER -168.24 176.26 6.05 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.502 1.126 . . . . 5.4800000000000004 110.99 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.488 ' OG ' ' N ' ' A' ' 58' ' ' ASP . 5.1 p -143.61 159.73 41.93 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.496 1.122 . . . . 2.3300000000000001 110.022 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.545 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 3.2 mt-30 -141.26 135.92 31.12 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.49 1.118 . . . . 2.04 110.333 -179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.411 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -100.51 117.87 35.55 Favored 'General case' 0 C--N 1.326 -0.444 0 O-C-N 124.47 1.106 . . . . 0.60999999999999999 109.258 -179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.421 ' C ' ' OD1' ' A' ' 24' ' ' ASP . 2.2 t0 -98.22 113.7 25.72 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.502 1.126 . . . . 2.7200000000000002 109.272 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.608 ' HB2' HG12 ' A' ' 48' ' ' VAL . 58.5 t-20 -78.16 102.19 7.42 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.524 1.14 . . . . 0.63 109.249 -179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.448 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.7 3.52 81.38 Favored Glycine 0 CA--C 1.53 1.007 0 O-C-N 124.452 1.095 . . . . 0.68000000000000005 110.985 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -84.13 -161.76 0.58 Allowed 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 108.342 -0.985 . . . . 1.45 108.342 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.464 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -130.5 21.22 5.15 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 1.3400000000000001 109.311 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.428 ' N ' ' HB3' ' A' ' 50' ' ' PRO . 0.1 OUTLIER -153.31 147.55 25.75 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.469 1.106 . . . . 3.4300000000000002 110.357 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.8 m -59.47 127.87 34.21 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 124.492 1.12 . . . . 0.76000000000000001 110.392 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.518 HG21 HH12 ' A' ' 72' ' ' ARG . 15.9 m -141.87 154.06 19.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.524 0 O-C-N 124.513 1.133 . . . . 0.76000000000000001 109.329 179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.688 HG21 ' SG ' ' A' ' 45' ' ' CYS . 1.8 m -101.73 141.19 34.97 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.524 1.14 . . . . 0.84999999999999998 110.425 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.411 HG21 ' CB ' ' A' ' 23' ' ' ALA . 1.8 m -129.93 170.69 18.64 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 O-C-N 124.445 1.091 . . . . 0.87 109.345 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.836 ' HG2' ' HB3' ' A' ' 71' ' ' ALA . 2.0 ptmt -160.64 89.46 0.82 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.504 1.128 . . . . 2.3700000000000001 109.289 179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.91 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.8 OUTLIER -40.03 139.01 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.522 1.139 . . . . 0.68999999999999995 109.35 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.906 HG22 ' HG2' ' A' ' 42' ' ' GLU . 75.0 t -118.03 117.29 54.33 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.531 1.144 . . . . 0.90000000000000002 109.282 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.583 ' CE2' ' HB3' ' A' ' 64' ' ' HIS . 78.4 m-85 -73.64 166.55 23.06 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.468 1.105 . . . . 0.98999999999999999 110.984 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.25 -5.59 33.24 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.505 1.128 . . . . 3.27 110.297 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.459 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -91.4 9.4 31.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.424 1.077 . . . . 2.6200000000000001 109.337 179.973 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.459 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.4 OUTLIER 78.52 -1.25 2.46 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.479 1.112 . . . . 3.9300000000000002 109.293 179.964 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 1.2 p -83.2 167.63 17.54 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.539 1.149 . . . . 1.22 110.395 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.906 ' HG2' HG22 ' A' ' 36' ' ' VAL . 16.3 mt-10 -134.54 170.28 16.01 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.475 1.109 . . . . 2.1699999999999999 110.306 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.564 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -83.83 -115.57 0.63 Allowed Glycine 0 CA--C 1.53 0.988 0 O-C-N 124.554 1.159 . . . . 2.0 111.017 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.564 HD23 ' O ' ' A' ' 43' ' ' GLY . 36.1 mt -148.44 147.58 29.32 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.501 0.766 . . . . 1.6100000000000001 109.299 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.688 ' SG ' HG21 ' A' ' 32' ' ' THR . 0.4 OUTLIER -47.2 120.33 3.09 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.48 1.112 . . . . 2.1299999999999999 108.285 179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 1.116 ' CD2' HG12 ' A' ' 56' ' ' VAL . 6.1 m-85 -137.22 108.05 6.65 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.525 1.141 . . . . 1.8999999999999999 110.973 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -84.27 134.61 34.52 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.532 1.145 . . . . 0.56999999999999995 109.255 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.809 HG22 ' HB ' ' A' ' 54' ' ' THR . 49.7 t -133.11 141.74 43.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 O-C-N 124.448 1.092 . . . . 0.33000000000000002 109.302 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -80.78 167.08 35.13 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.474 1.109 . . . . 0.53000000000000003 109.291 179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.1 Cg_endo -75.09 117.98 5.08 Favored 'Trans proline' 0 C--N 1.36 1.155 0 O-C-N 124.514 1.797 . . . . 0.87 110.954 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.6 28.76 18.25 Favored Glycine 0 CA--C 1.53 1.017 0 O-C-N 124.492 1.12 . . . . 1.02 111.007 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.937 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -132.16 167.18 20.21 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.483 0.755 . . . . 2.4500000000000002 110.297 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.937 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.3 OUTLIER -135.75 125.11 40.47 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.469 0 O-C-N 124.518 1.136 . . . . 1.1200000000000001 109.284 179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.809 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -125.78 137.23 53.78 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.499 1.124 . . . . 1.0 110.381 -179.977 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.473 HG23 ' O ' ' A' ' 21' ' ' SER . 6.1 m -82.03 127.65 33.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.487 1.117 . . . . 1.9099999999999999 110.431 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 1.116 HG12 ' CD2' ' A' ' 46' ' ' TYR . 3.6 m -95.83 -51.97 10.01 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.522 1.138 . . . . 3.21 109.36 179.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.616 ' HA2' ' CD1' ' A' ' 20' ' ' TYR . . . 119.63 89.6 1.2 Allowed Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.517 1.136 . . . . 2.73 110.993 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.843 ' CG ' HG11 ' A' ' 35' ' ' VAL . 7.7 m-20 -170.24 126.32 0.79 Allowed 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.508 0.77 . . . . 6.1799999999999997 109.354 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.491 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -131.76 162.27 23.8 Favored Glycine 0 CA--C 1.53 0.987 0 O-C-N 124.494 1.121 . . . . 1.28 110.993 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.754 ' CE1' HG22 ' A' ' 61' ' ' ILE . 42.6 p90 -95.54 -6.94 39.29 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.495 0.762 . . . . 2.1299999999999999 111.023 179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.983 HD12 ' O ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -96.98 12.09 4.8 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.484 1.115 . . . . 2.3999999999999999 109.269 -179.968 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.503 ' N ' HD13 ' A' ' 61' ' ' ILE . . . -100.98 -173.7 29.02 Favored Glycine 0 CA--C 1.531 1.038 0 O-C-N 124.472 1.107 . . . . 2.5800000000000001 110.949 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 19.1 p -90.89 -13.23 34.01 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.53 0.782 . . . . 4.4100000000000001 109.988 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.583 ' HB3' ' CE2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -79.43 1.49 25.29 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.511 1.132 . . . . 1.8 109.553 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 81.9 -142.88 22.83 Favored Glycine 0 CA--C 1.53 1.021 0 O-C-N 124.479 1.112 . . . . 0.91000000000000003 110.978 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.579 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.1 OUTLIER -116.45 165.08 13.63 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.507 0.769 . . . . 1.1599999999999999 109.575 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.674 ' HB3' ' OE1' ' A' ' 16' ' ' GLN . . . -83.01 121.6 27.22 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 124.561 1.163 . . . . 0.70999999999999996 109.321 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.542 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -75.74 -46.3 31.72 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.419 1.075 . . . . 4.5099999999999998 110.273 -179.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.541 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 17.9 p90 178.92 161.74 0.72 Allowed 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.494 1.121 . . . . 1.6100000000000001 111.002 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.91 ' CD2' HG23 ' A' ' 35' ' ' VAL . 17.4 mt -81.57 139.96 34.76 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.5 1.125 . . . . 1.3999999999999999 109.311 179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.836 ' HB3' ' HG2' ' A' ' 34' ' ' LYS . . . -117.22 132.06 56.72 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.482 1.114 . . . . 0.62 109.319 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.576 ' NH1' HG21 ' A' ' 12' ' ' VAL . 3.9 mmt180 -63.5 144.87 56.62 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.522 1.139 . . . . 5.5899999999999999 110.295 -179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.875 ' C ' HD23 ' A' ' 74' ' ' LEU . 50.9 t -126.4 143.86 51.03 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.547 1.155 . . . . 2.73 108.276 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.875 HD23 ' C ' ' A' ' 73' ' ' CYS . 0.6 OUTLIER . . . . . 0 C--O 1.25 1.116 0 CA-C-O 116.98 -1.486 . . . . 5.5999999999999996 109.29 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.407 ' C ' ' OG1' ' A' ' 2' ' ' THR . 0.9 OUTLIER . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.317 -0.623 . . . . 13.619999999999999 109.317 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.413 ' O ' ' HB ' ' A' ' 3' ' ' THR . 2.2 p 43.52 -167.63 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 11.83 110.393 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.413 ' HB ' ' O ' ' A' ' 2' ' ' THR . 1.0 OUTLIER 179.55 55.79 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.127 . . . . 7.5499999999999998 110.384 179.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.447 ' O ' ' N ' ' A' ' 6' ' ' GLU . 7.0 t -82.06 78.17 1.17 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.465 1.103 . . . . 8.3599999999999994 109.298 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.2 m 46.98 -94.41 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.5 1.125 . . . . 3.0299999999999998 109.988 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.447 ' N ' ' O ' ' A' ' 4' ' ' VAL . 1.2 mt-10 176.82 95.32 0.11 Allowed Pre-proline 0 C--N 1.325 -0.478 0 O-C-N 124.529 1.143 . . . . 4.3399999999999999 110.278 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.96 134.73 18.24 Favored 'Trans proline' 0 C--N 1.36 1.137 0 O-C-N 124.524 1.802 . . . . 0.69999999999999996 111.024 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -58.37 166.75 2.04 Favored Pre-proline 0 C--N 1.324 -0.513 0 O-C-N 124.496 1.122 . . . . 0.66000000000000003 109.322 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.632 ' HB3' HH21 ' A' ' 72' ' ' ARG . 18.3 Cg_endo -75.05 176.1 10.37 Favored 'Trans proline' 0 C--N 1.36 1.157 0 O-C-N 124.509 1.794 . . . . 0.77000000000000002 111.027 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.4 t -92.2 13.99 17.52 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.479 1.112 . . . . 2.5099999999999998 110.0 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 7.4 p -99.94 -18.23 17.18 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.5 1.125 . . . . 1.1599999999999999 108.29 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.834 HG12 HD12 ' A' ' 70' ' ' LEU . 1.4 t -97.77 117.9 43.34 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 O-C-N 124.548 1.155 . . . . 1.01 109.303 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -86.98 139.55 30.48 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.461 1.101 . . . . 1.25 110.39 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.87 HD13 HD21 ' A' ' 70' ' ' LEU . 10.3 tp -96.86 114.12 25.72 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 0.77000000000000002 109.283 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.498 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.8 OUTLIER -106.97 70.37 0.8 Allowed 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.5 1.125 . . . . 1.23 111.002 -179.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.732 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 24.9 tt0 -78.6 127.8 32.62 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.477 1.11 . . . . 1.3999999999999999 110.317 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.596 ' O ' ' CE2' ' A' ' 60' ' ' TYR . 1.7 p -110.8 -151.63 0.48 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.52 1.138 . . . . 1.1100000000000001 109.985 -179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.671 ' HB2' HG21 ' A' ' 61' ' ' ILE . 28.1 p-90 -97.5 -47.49 5.64 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.524 1.14 . . . . 2.1899999999999999 108.026 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -37.55 55.29 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.504 1.128 . . . . 6.0800000000000001 110.278 -179.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.547 ' C ' ' O ' ' A' ' 58' ' ' ASP . 6.4 p90 -166.22 -177.06 3.94 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.561 1.163 . . . . 7.2000000000000002 110.981 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.512 ' O ' HG23 ' A' ' 55' ' ' THR . 27.4 t -117.97 164.07 15.63 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.49 1.119 . . . . 2.73 109.968 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.498 ' O ' ' CB ' ' A' ' 15' ' ' TYR . 0.0 OUTLIER -138.41 130.34 28.23 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.53 1.144 . . . . 1.95 110.286 -179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -95.1 119.37 33.5 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 0.56999999999999995 109.301 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.626 ' HA ' HG23 ' A' ' 53' ' ' ILE . 2.1 t0 -97.68 115.59 28.25 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 2.25 109.26 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.457 ' ND2' ' O ' ' A' ' 49' ' ' ALA . 38.3 t-20 -77.59 84.56 3.95 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.474 1.109 . . . . 0.66000000000000003 109.269 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.78 15.7 59.96 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.502 1.127 . . . . 0.67000000000000004 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.413 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -93.78 11.35 29.52 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.313 -0.995 . . . . 2.7599999999999998 108.313 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.45 ' C ' ' HB3' ' A' ' 50' ' ' PRO . . . 39.5 32.45 0.09 Allowed 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.488 1.118 . . . . 2.02 109.321 179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.48 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.7 OUTLIER -158.01 133.72 9.07 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.555 1.159 . . . . 2.5899999999999999 110.321 -179.98 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.42 HG23 ' HA ' ' A' ' 49' ' ' ALA . 3.0 m -50.23 119.33 3.58 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.474 1.109 . . . . 0.89000000000000001 110.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.48 HG13 ' O ' ' A' ' 29' ' ' GLU . 27.4 m -145.82 163.68 10.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 O-C-N 124.456 1.098 . . . . 0.65000000000000002 109.304 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.447 ' OG1' ' HB2' ' A' ' 47' ' ' ALA . 23.3 m -117.66 146.63 43.57 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.535 1.147 . . . . 0.66000000000000003 110.409 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.548 HG11 HG11 ' A' ' 12' ' ' VAL . 1.1 m -142.31 176.75 3.5 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 O-C-N 124.512 1.133 . . . . 0.57999999999999996 109.308 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.828 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 0.7 OUTLIER -160.19 103.56 1.45 Allowed 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.516 1.135 . . . . 2.4700000000000002 109.338 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 1.043 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -60.44 137.03 23.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 O-C-N 124.501 1.126 . . . . 0.56000000000000005 109.341 179.996 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.885 HG22 ' HG2' ' A' ' 42' ' ' GLU . 13.0 t -116.64 124.23 72.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.525 1.141 . . . . 0.85999999999999999 109.275 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.664 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 54.6 m-85 -76.26 166.71 23.07 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.466 1.104 . . . . 1.03 111.03 179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.563 ' HA ' ' CD ' ' A' ' 68' ' ' ARG . 1.2 tt0 -61.42 -14.38 27.79 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.486 1.116 . . . . 3.6200000000000001 110.29 -179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.597 ' HB2' HG23 ' A' ' 41' ' ' THR . 0.0 OUTLIER -84.87 7.93 19.23 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.458 1.099 . . . . 1.97 109.265 -179.97 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 3.1 t0 71.92 6.21 5.55 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.445 1.09 . . . . 3.9300000000000002 109.278 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.597 HG23 ' HB2' ' A' ' 39' ' ' ASP . 42.5 p -87.35 151.3 23.22 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.495 1.122 . . . . 0.98999999999999999 110.409 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.885 ' HG2' HG22 ' A' ' 36' ' ' VAL . 4.6 mt-10 -118.52 141.42 48.58 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.512 1.132 . . . . 1.9399999999999999 110.338 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -65.89 -94.54 0.03 OUTLIER Glycine 0 CA--C 1.53 1.018 0 O-C-N 124.475 1.109 . . . . 1.77 111.0 -179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 43' ' ' GLY . 50.8 mt -153.84 139.86 18.29 Favored 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.554 0.797 . . . . 1.3100000000000001 109.333 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.86 113.91 8.4 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.505 1.128 . . . . 1.6299999999999999 108.324 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.456 ' HD2' HG12 ' A' ' 56' ' ' VAL . 3.3 m-85 -124.03 138.47 54.44 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.521 1.138 . . . . 2.0600000000000001 111.019 179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.447 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -96.09 115.6 27.68 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.506 1.129 . . . . 0.64000000000000001 109.318 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.968 HG22 ' HB ' ' A' ' 54' ' ' THR . 96.5 t -99.72 131.94 46.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 O-C-N 124.511 1.132 . . . . 0.51000000000000001 109.36 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.69 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -68.44 171.97 5.19 Favored Pre-proline 0 C--N 1.325 -0.477 0 O-C-N 124.508 1.13 . . . . 0.94999999999999996 109.334 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.69 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -74.99 111.54 3.35 Favored 'Trans proline' 0 C--N 1.361 1.193 0 O-C-N 124.5 1.789 . . . . 1.46 110.981 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.33 21.58 44.31 Favored Glycine 0 CA--C 1.53 1.027 0 O-C-N 124.52 1.137 . . . . 0.68000000000000005 111.016 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.863 ' HG3' HG13 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -123.03 155.27 37.18 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.514 0.773 . . . . 2.8799999999999999 110.268 -179.964 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.626 HG23 ' HA ' ' A' ' 24' ' ' ASP . 0.6 OUTLIER -122.36 129.49 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 O-C-N 124.529 1.143 . . . . 1.1799999999999999 109.328 179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.968 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.3 OUTLIER -126.92 138.6 53.32 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.459 1.099 . . . . 0.94999999999999996 110.425 179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.534 ' CG2' ' CD1' ' A' ' 20' ' ' TYR . 2.0 m -78.41 139.48 38.75 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.489 1.118 . . . . 1.3200000000000001 110.347 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.495 HG21 ' HB ' ' A' ' 35' ' ' VAL . 3.6 m -113.51 -50.49 5.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.548 1.155 . . . . 2.2200000000000002 109.291 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.463 ' O ' HG11 ' A' ' 35' ' ' VAL . . . 132.53 123.14 2.41 Favored Glycine 0 CA--C 1.531 1.037 0 O-C-N 124.471 1.107 . . . . 2.8999999999999999 110.962 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.664 ' OD1' ' CE2' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 165.78 127.13 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.536 0.786 . . . . 7.0300000000000002 109.278 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -147.52 123.42 1.73 Allowed Glycine 0 CA--C 1.53 0.996 0 O-C-N 124.51 1.131 . . . . 1.3999999999999999 110.983 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.598 ' HB2' ' CE1' ' A' ' 66' ' ' HIS . 15.2 p90 -70.39 1.87 4.52 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.48 0.753 . . . . 2.6200000000000001 111.008 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.671 HG21 ' HB2' ' A' ' 18' ' ' TRP . 9.6 tt -110.94 38.16 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 O-C-N 124.461 1.101 . . . . 4.6399999999999997 109.316 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -139.45 -174.38 13.58 Favored Glycine 0 CA--C 1.53 1.003 0 O-C-N 124.516 1.135 . . . . 2.3500000000000001 111.003 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 89.9 p -91.27 -6.24 53.52 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.531 0.783 . . . . 4.3200000000000003 110.001 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.612 ' HB3' ' CD2' ' A' ' 37' ' ' TYR . 0.0 OUTLIER -81.51 3.92 23.12 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.523 1.139 . . . . 2.0099999999999998 109.605 179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 74.99 -148.36 37.82 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.505 1.128 . . . . 1.0900000000000001 111.002 179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.598 ' CE1' ' HB2' ' A' ' 60' ' ' TYR . 1.7 m170 -120.53 135.73 54.99 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.482 0.754 . . . . 1.45 109.611 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.732 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -36.73 134.59 0.48 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.516 1.135 . . . . 0.89000000000000001 109.329 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.563 ' CD ' ' HA ' ' A' ' 38' ' ' GLU . 0.0 OUTLIER -91.49 -47.24 7.54 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.473 1.108 . . . . 4.7800000000000002 110.269 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.582 ' CD1' ' HB ' ' A' ' 36' ' ' VAL . 0.9 OUTLIER -178.11 173.95 1.42 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.489 1.118 . . . . 2.25 110.993 179.981 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 1.043 ' CD2' HG23 ' A' ' 35' ' ' VAL . 4.5 mt -96.85 144.78 26.48 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.486 1.117 . . . . 1.5 109.249 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.828 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -125.94 129.58 49.56 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.494 1.121 . . . . 0.47999999999999998 109.289 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.632 HH21 ' HB3' ' A' ' 9' ' ' PRO . 4.5 ptp180 -85.57 141.74 29.63 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.53 1.144 . . . . 3.79 110.316 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.29 -4.37 50.45 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.484 1.115 . . . . 2.1000000000000001 108.305 179.996 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.429 ' HA ' HD22 ' A' ' 74' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.108 0 CA-C-O 117.0 -1.476 . . . . 5.4199999999999999 109.314 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.472 ' O ' HG23 ' A' ' 2' ' ' THR . 4.2 p-10 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.317 -0.623 . . . . 12.470000000000001 109.317 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.472 HG23 ' O ' ' A' ' 1' ' ' ASP . 2.4 p -153.52 -97.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.489 1.118 . . . . 12.109999999999999 110.403 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.577 HG22 ' H ' ' A' ' 4' ' ' VAL . 2.6 m -116.78 -152.52 0.51 Allowed 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.498 1.124 . . . . 8.1999999999999993 110.41 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.577 ' H ' HG22 ' A' ' 3' ' ' THR . 13.6 p -113.81 38.07 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 O-C-N 124.459 1.099 . . . . 6.7199999999999998 109.308 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.7 m -110.23 -174.83 2.58 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.516 1.135 . . . . 2.9900000000000002 110.011 -179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.416 ' O ' ' HA ' ' A' ' 71' ' ' ALA . 1.8 tt0 -140.94 132.45 13.81 Favored Pre-proline 0 C--N 1.325 -0.488 0 O-C-N 124.536 1.147 . . . . 3.0 110.238 -179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.03 138.37 22.88 Favored 'Trans proline' 0 C--N 1.361 1.197 0 O-C-N 124.512 1.796 . . . . 0.71999999999999997 110.994 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.67 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.68 170.09 0.31 Allowed Pre-proline 0 C--N 1.325 -0.465 0 O-C-N 124.486 1.116 . . . . 0.67000000000000004 109.309 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.67 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.2 Cg_endo -75.03 167.46 26.98 Favored 'Trans proline' 0 C--N 1.36 1.134 0 O-C-N 124.474 1.776 . . . . 0.94999999999999996 110.977 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 45.5 p -85.06 7.67 20.67 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.517 1.136 . . . . 2.6000000000000001 110.008 -179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.465 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 6.1 p -114.76 29.79 7.78 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.47 1.106 . . . . 1.01 108.255 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 33' ' ' VAL . 89.1 t -143.25 109.66 1.55 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 O-C-N 124.536 1.148 . . . . 0.63 109.299 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -79.43 153.79 29.43 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.521 1.138 . . . . 0.91000000000000003 110.436 179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.525 HD13 HG23 ' A' ' 35' ' ' VAL . 15.1 tp -105.23 105.91 16.16 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.443 1.09 . . . . 0.54000000000000004 109.327 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.49 ' N ' ' O ' ' A' ' 22' ' ' GLN . 0.4 OUTLIER -88.64 57.27 4.11 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.541 1.15 . . . . 1.71 110.946 -179.947 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.533 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 25.6 tt0 -76.26 100.71 5.18 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.532 1.145 . . . . 1.3999999999999999 110.3 179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.627 ' O ' ' CE1' ' A' ' 60' ' ' TYR . 1.4 p -77.79 -150.41 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 124.445 1.091 . . . . 1.0900000000000001 109.984 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 1.101 ' CA ' HD11 ' A' ' 61' ' ' ILE . 34.6 p-90 -98.45 -65.18 0.98 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.045 -1.094 . . . . 2.2000000000000002 108.045 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.594 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -93.1 16.68 12.33 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 124.486 1.116 . . . . 5.8600000000000003 110.329 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 1.082 ' CE2' HG21 ' A' ' 55' ' ' THR . 0.0 OUTLIER -168.71 161.62 11.3 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.502 1.126 . . . . 5.0099999999999998 110.984 -179.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.486 ' OG ' ' C ' ' A' ' 57' ' ' GLY . 65.1 p -143.28 135.6 27.16 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.497 1.123 . . . . 2.2599999999999998 110.027 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.609 ' OE1' HG23 ' A' ' 55' ' ' THR . 0.0 OUTLIER -135.25 177.87 7.47 Favored 'General case' 0 C--N 1.325 -0.5 0 O-C-N 124.507 1.129 . . . . 2.4500000000000002 110.314 179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -135.23 133.72 39.28 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.524 1.14 . . . . 0.65000000000000002 109.266 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.473 ' HA ' ' CG1' ' A' ' 53' ' ' ILE . 39.8 t0 -103.29 130.44 50.56 Favored 'General case' 0 C--N 1.324 -0.501 0 O-C-N 124.547 1.155 . . . . 2.29 109.262 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.638 ' HB2' HG12 ' A' ' 48' ' ' VAL . 23.7 t-20 -84.4 96.87 9.21 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.444 1.09 . . . . 0.62 109.285 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.443 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -86.47 2.01 87.36 Favored Glycine 0 CA--C 1.529 0.968 0 O-C-N 124.53 1.144 . . . . 0.64000000000000001 111.023 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.465 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -88.94 -157.76 0.46 Allowed 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.272 -1.01 . . . . 1.6200000000000001 108.272 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.414 ' CA ' ' HB3' ' A' ' 50' ' ' PRO . . . -131.1 16.29 5.1 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.512 1.132 . . . . 1.1499999999999999 109.315 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -144.14 152.15 40.53 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.562 1.164 . . . . 2.9900000000000002 110.285 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 48' ' ' VAL . 90.7 m -71.48 130.8 42.19 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.528 1.143 . . . . 1.0 110.392 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 31.8 m -141.46 164.0 20.02 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.456 0 O-C-N 124.467 1.105 . . . . 0.59999999999999998 109.294 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.467 HG22 ' SG ' ' A' ' 73' ' ' CYS . 74.9 m -113.25 141.44 46.99 Favored 'General case' 0 C--N 1.325 -0.473 0 O-C-N 124.487 1.117 . . . . 0.67000000000000004 110.415 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.578 HG11 HG11 ' A' ' 12' ' ' VAL . 1.2 m -137.74 174.17 11.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.468 1.105 . . . . 0.56999999999999995 109.282 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.645 ' HG3' ' HB3' ' A' ' 71' ' ' ALA . 5.3 pttt -155.33 105.21 2.47 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.517 1.135 . . . . 1.9399999999999999 109.316 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.595 ' HA ' HD23 ' A' ' 70' ' ' LEU . 0.4 OUTLIER -58.27 115.65 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 O-C-N 124.516 1.135 . . . . 0.78000000000000003 109.248 -179.977 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.876 HG22 ' HG2' ' A' ' 42' ' ' GLU . 99.2 t -98.85 119.3 46.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.503 1.127 . . . . 0.56000000000000005 109.277 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.623 ' CD1' ' O ' ' A' ' 64' ' ' HIS . 68.7 m-85 -78.61 170.05 17.26 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.485 1.116 . . . . 1.22 110.998 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.485 ' HG3' ' CG ' ' A' ' 68' ' ' ARG . 0.0 OUTLIER -68.05 -12.45 60.85 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.527 1.142 . . . . 4.46 110.297 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -89.3 16.62 7.13 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.504 1.128 . . . . 1.8 109.285 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 21.2 t0 65.22 10.68 6.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.524 1.14 . . . . 3.9199999999999999 109.306 179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.575 ' HB ' ' CE1' ' A' ' 64' ' ' HIS . 0.1 OUTLIER -83.99 155.07 22.95 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.547 1.154 . . . . 1.23 110.381 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.876 ' HG2' HG22 ' A' ' 36' ' ' VAL . 13.0 mt-10 -133.33 127.07 32.75 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.485 1.116 . . . . 2.3300000000000001 110.273 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.721 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -52.29 -105.28 0.01 OUTLIER Glycine 0 CA--C 1.53 0.975 0 O-C-N 124.496 1.123 . . . . 1.79 110.989 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.721 HD23 ' O ' ' A' ' 43' ' ' GLY . 49.9 mt -153.23 138.06 17.09 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.442 0.731 . . . . 1.4199999999999999 109.302 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.429 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.1 OUTLIER -55.05 112.08 0.98 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.529 1.143 . . . . 1.3899999999999999 108.282 -179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.598 ' CD2' ' O ' ' A' ' 44' ' ' LEU . 35.2 m-85 -121.74 123.71 42.48 Favored 'General case' 0 C--N 1.326 -0.445 0 O-C-N 124.525 1.141 . . . . 1.52 110.983 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -91.45 120.18 32.07 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.53 1.144 . . . . 0.46000000000000002 109.3 -179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.638 HG12 ' HB2' ' A' ' 25' ' ' ASN . 53.4 t -115.9 142.7 28.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.495 1.122 . . . . 0.40000000000000002 109.331 179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.654 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -86.31 169.47 15.18 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 124.554 1.159 . . . . 0.51000000000000001 109.352 179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.654 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.0 104.84 1.97 Allowed 'Trans proline' 0 C--N 1.36 1.159 0 O-C-N 124.517 1.798 . . . . 0.75 111.02 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.86 34.78 2.93 Favored Glycine 0 CA--C 1.53 0.972 0 O-C-N 124.494 1.121 . . . . 0.76000000000000001 111.022 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -152.33 158.08 42.23 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.461 0.741 . . . . 2.3399999999999999 110.276 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.473 ' CG1' ' HA ' ' A' ' 24' ' ' ASP . 8.0 mt -126.21 153.33 34.47 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.478 1.111 . . . . 2.02 109.294 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.536 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.5 OUTLIER -153.65 142.94 21.51 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.459 1.099 . . . . 0.85999999999999999 110.401 179.992 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 1.082 HG21 ' CE2' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -62.84 142.89 58.04 Favored 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.497 1.123 . . . . 1.26 110.391 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.52 ' CG2' ' HB ' ' A' ' 35' ' ' VAL . 4.4 m -122.92 -7.28 8.18 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 O-C-N 124.486 1.116 . . . . 2.0499999999999998 109.29 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.486 ' C ' ' OG ' ' A' ' 21' ' ' SER . . . 159.48 -156.17 27.3 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.485 1.115 . . . . 2.3799999999999999 111.027 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.452 ' HA ' ' HA ' ' A' ' 20' ' ' TYR . 0.5 OUTLIER -91.65 179.0 5.76 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.513 0.773 . . . . 6.21 109.304 179.975 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.471 ' HA3' ' O ' ' A' ' 18' ' ' TRP . . . -89.45 -145.43 12.25 Favored Glycine 0 CA--C 1.53 1.008 0 O-C-N 124.542 1.151 . . . . 1.4299999999999999 110.959 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.627 ' CE1' ' O ' ' A' ' 17' ' ' SER . 0.1 OUTLIER -98.46 -1.2 41.91 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.491 0.76 . . . . 2.7200000000000002 110.968 -179.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 1.101 HD11 ' CA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -107.32 37.13 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.472 1.107 . . . . 4.4000000000000004 109.341 179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -125.75 -164.23 11.76 Favored Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.454 1.097 . . . . 3.1299999999999999 110.987 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 10.9 m -91.51 -5.0 54.88 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.526 0.78 . . . . 3.7200000000000002 110.019 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.623 ' O ' ' CD1' ' A' ' 37' ' ' TYR . 6.1 m-70 -100.01 39.14 1.36 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.488 1.118 . . . . 2.2400000000000002 109.604 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 45.84 -137.61 7.35 Favored Glycine 0 CA--C 1.53 0.982 0 O-C-N 124.49 1.118 . . . . 0.90000000000000002 111.01 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.529 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.8 OUTLIER -121.27 123.49 42.33 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.522 0.778 . . . . 1.1200000000000001 109.56 -179.987 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.533 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -43.06 117.76 1.14 Allowed 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.455 1.097 . . . . 0.56000000000000005 109.306 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 36' ' ' VAL . 0.7 OUTLIER -76.62 -40.9 47.9 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.509 1.131 . . . . 4.4299999999999997 110.326 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.445 ' CD2' ' HB3' ' A' ' 68' ' ' ARG . 12.5 p90 -178.24 -170.21 0.22 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.541 1.15 . . . . 1.02 110.959 180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.595 HD23 ' HA ' ' A' ' 35' ' ' VAL . 51.8 mt -114.64 134.5 55.02 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.516 1.135 . . . . 1.1599999999999999 109.329 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.645 ' HB3' ' HG3' ' A' ' 34' ' ' LYS . . . -113.92 130.0 56.55 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.478 1.111 . . . . 0.53000000000000003 109.297 -179.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.516 ' HD3' HD11 ' A' ' 74' ' ' LEU . 3.3 ptp180 -86.49 138.69 31.54 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.441 1.088 . . . . 4.6600000000000001 110.276 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.756 ' C ' HD13 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -112.77 113.34 25.4 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.486 1.116 . . . . 2.4199999999999999 108.295 -179.983 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.786 HD13 ' N ' ' A' ' 74' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 116.97 -1.491 . . . . 5.29 109.275 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.313 -0.625 . . . . 14.81 109.313 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.604 HG23 ' H ' ' A' ' 3' ' ' THR . 0.4 OUTLIER -175.91 -60.62 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.519 1.137 . . . . 10.800000000000001 110.366 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . 0.604 ' H ' HG23 ' A' ' 2' ' ' THR . 11.0 t 43.76 -163.28 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.464 1.103 . . . . 9.2300000000000004 110.413 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.421 ' N ' ' OG1' ' A' ' 3' ' ' THR . 7.8 m -130.46 135.11 61.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.505 1.128 . . . . 8.8599999999999994 109.28 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.419 ' CB ' ' OH ' ' A' ' 69' ' ' TYR . 1.9 m 53.7 -146.41 0.54 Allowed 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.484 1.115 . . . . 3.7999999999999998 110.013 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.56 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 1.3 tt0 -149.54 106.5 3.3 Favored Pre-proline 0 C--N 1.325 -0.464 0 O-C-N 124.45 1.094 . . . . 3.73 110.267 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -74.97 142.93 28.56 Favored 'Trans proline' 0 C--N 1.36 1.174 0 O-C-N 124.538 1.81 . . . . 0.70999999999999996 111.031 179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.884 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -74.43 179.81 1.2 Allowed Pre-proline 0 C--N 1.324 -0.509 0 O-C-N 124.482 1.114 . . . . 0.75 109.296 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.884 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.4 Cg_endo -74.94 165.19 31.88 Favored 'Trans proline' 0 C--N 1.36 1.179 0 O-C-N 124.545 1.813 . . . . 0.94999999999999996 111.018 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.7 m -90.47 16.26 9.23 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.554 1.159 . . . . 2.3100000000000001 110.006 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.455 ' O ' ' N ' ' A' ' 26' ' ' GLY . 26.6 p -108.43 12.28 26.35 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.493 1.121 . . . . 0.90000000000000002 108.293 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 33' ' ' VAL . 75.4 t -128.07 117.57 46.14 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 O-C-N 124.52 1.137 . . . . 0.68999999999999995 109.288 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -81.34 145.45 30.86 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.505 1.128 . . . . 0.96999999999999997 110.386 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.572 HD13 HD21 ' A' ' 70' ' ' LEU . 43.9 tp -101.63 105.46 16.4 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.506 1.129 . . . . 0.58999999999999997 109.326 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.547 ' CB ' ' O ' ' A' ' 22' ' ' GLN . 0.3 OUTLIER -98.08 65.91 1.79 Allowed 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.495 1.122 . . . . 1.3600000000000001 110.999 179.988 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.71 ' NE2' ' H ' ' A' ' 67' ' ' ALA . 6.7 tt0 -79.5 118.27 21.21 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.449 1.093 . . . . 1.3300000000000001 110.312 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.449 ' CB ' ' O ' ' A' ' 20' ' ' TYR . 1.0 OUTLIER -100.84 -157.55 0.62 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.505 1.128 . . . . 1.22 110.007 -179.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.876 ' HB2' HG23 ' A' ' 61' ' ' ILE . 62.9 p-90 -96.06 -45.35 6.93 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.522 1.139 . . . . 2.04 107.991 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.574 ' HB3' ' CZ3' ' A' ' 18' ' ' TRP . 17.9 ptt180 -77.53 -37.02 51.78 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.45 1.094 . . . . 7.1500000000000004 110.31 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.633 ' CD2' ' HA2' ' A' ' 57' ' ' GLY . 0.3 OUTLIER -164.6 173.7 11.67 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.454 1.096 . . . . 7.0199999999999996 111.01 -179.994 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.51 ' O ' ' CG2' ' A' ' 55' ' ' THR . 54.4 p -116.75 158.12 24.38 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.508 1.13 . . . . 2.1699999999999999 109.992 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.798 ' HG2' HG22 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -142.76 134.44 26.67 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.475 1.109 . . . . 3.04 110.315 179.997 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.463 ' CB ' HG21 ' A' ' 33' ' ' VAL . . . -98.01 128.68 44.71 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.495 1.122 . . . . 0.44 109.282 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.703 ' HA ' HG23 ' A' ' 53' ' ' ILE . 0.6 OUTLIER -106.22 120.4 41.73 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.547 1.155 . . . . 2.48 109.32 179.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.639 ' HB2' HG12 ' A' ' 48' ' ' VAL . 60.6 t-20 -77.81 89.98 4.06 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.549 1.155 . . . . 0.52000000000000002 109.286 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -83.98 8.16 67.8 Favored Glycine 0 CA--C 1.531 1.036 0 O-C-N 124.527 1.142 . . . . 0.76000000000000001 110.989 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.65 -156.36 0.24 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.314 -0.995 . . . . 1.8 108.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -137.35 18.84 2.94 Favored 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.51 1.131 . . . . 1.04 109.279 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.74 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.2 mt-10 -155.85 135.05 12.19 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.49 1.119 . . . . 1.98 110.241 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.5 m -41.67 124.83 2.62 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.495 1.122 . . . . 0.78000000000000003 110.406 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.74 HG13 ' O ' ' A' ' 29' ' ' GLU . 17.5 m -139.35 154.8 25.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 O-C-N 124.5 1.125 . . . . 0.93000000000000005 109.292 -179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.527 HG22 ' HB2' ' A' ' 73' ' ' CYS . 30.7 m -108.09 146.18 33.0 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.481 1.113 . . . . 0.88 110.378 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.947 HG11 HG11 ' A' ' 12' ' ' VAL . 2.6 m -138.16 172.01 14.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 O-C-N 124.54 1.15 . . . . 0.79000000000000004 109.278 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.401 ' HD3' ' OE1' ' A' ' 42' ' ' GLU . 0.0 OUTLIER -162.01 101.11 1.12 Allowed 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.468 1.105 . . . . 2.7599999999999998 109.279 179.983 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.802 HG23 ' CD2' ' A' ' 70' ' ' LEU . 0.4 OUTLIER -59.98 133.82 25.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 O-C-N 124.457 1.098 . . . . 0.68000000000000005 109.344 179.95 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.565 ' O ' ' N ' ' A' ' 68' ' ' ARG . 90.6 t -113.22 124.68 70.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 124.507 1.129 . . . . 0.68000000000000005 109.296 179.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.638 ' CZ ' ' OD1' ' A' ' 58' ' ' ASP . 11.7 m-85 -75.83 166.35 23.65 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.446 1.092 . . . . 1.6100000000000001 111.025 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.408 ' O ' ' OE1' ' A' ' 38' ' ' GLU . 1.7 tm-20 -72.26 -8.01 52.53 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.53 1.143 . . . . 3.4199999999999999 110.308 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -95.69 10.13 37.95 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.524 1.14 . . . . 2.0299999999999998 109.251 -179.97 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER 80.78 8.47 1.21 Allowed 'General case' 0 C--N 1.324 -0.506 0 O-C-N 124.523 1.139 . . . . 4.9800000000000004 109.294 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.431 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 0.0 OUTLIER -79.77 166.71 21.48 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.514 1.134 . . . . 1.96 110.429 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.409 ' CD ' HG22 ' A' ' 36' ' ' VAL . 2.4 mt-10 -131.93 153.11 50.62 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.516 1.135 . . . . 3.25 110.308 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.474 ' N ' ' O ' ' A' ' 35' ' ' VAL . . . -99.38 33.31 6.28 Favored Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.463 1.102 . . . . 3.3900000000000001 110.966 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB3' ' CZ ' ' A' ' 46' ' ' TYR . 0.5 OUTLIER 60.35 151.8 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.51 0.77 . . . . 2.52 109.327 -179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 73' ' ' CYS . 0.0 OUTLIER -85.26 141.54 30.03 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.521 1.138 . . . . 2.4500000000000002 108.253 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.773 ' HD2' HG12 ' A' ' 56' ' ' VAL . 27.7 m-85 -150.29 135.71 18.07 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.49 1.118 . . . . 2.4199999999999999 110.995 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -87.46 141.73 28.41 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.543 1.152 . . . . 0.77000000000000002 109.277 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.657 HG22 ' HB ' ' A' ' 54' ' ' THR . 44.2 t -137.15 134.06 47.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 O-C-N 124.515 1.134 . . . . 0.63 109.321 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -71.83 166.44 40.18 Favored Pre-proline 0 C--N 1.325 -0.479 0 O-C-N 124.527 1.142 . . . . 0.63 109.325 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.3 Cg_endo -75.02 113.96 3.91 Favored 'Trans proline' 0 C--N 1.36 1.139 0 O-C-N 124.503 1.791 . . . . 0.72999999999999998 111.007 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 98.72 8.57 54.25 Favored Glycine 0 CA--C 1.53 1.023 0 O-C-N 124.512 1.133 . . . . 0.79000000000000004 111.024 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.12 161.85 17.83 Favored 'General case' 0 C--N 1.324 -0.5 0 O-C-N 124.539 0.788 . . . . 2.4700000000000002 110.324 179.965 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.798 HG22 ' HG2' ' A' ' 22' ' ' GLN . 0.0 OUTLIER -128.7 148.32 33.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.75 109.299 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.657 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -150.38 136.29 18.43 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.532 1.145 . . . . 0.92000000000000004 110.399 -179.961 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.51 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.4 m -74.75 138.4 42.68 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 124.523 1.139 . . . . 1.1000000000000001 110.43 179.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.773 HG12 ' HD2' ' A' ' 46' ' ' TYR . 10.5 m -110.45 -51.28 6.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 O-C-N 124.501 1.125 . . . . 2.2400000000000002 109.323 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.633 ' HA2' ' CD2' ' A' ' 20' ' ' TYR . . . 133.09 117.4 1.82 Allowed Glycine 0 CA--C 1.53 1.031 0 O-C-N 124.513 1.133 . . . . 3.0800000000000001 110.993 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.638 ' OD1' ' CZ ' ' A' ' 37' ' ' TYR . 0.4 OUTLIER 162.6 130.4 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.528 0.781 . . . . 6.9400000000000004 109.276 -179.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.441 ' HA2' ' O ' ' A' ' 17' ' ' SER . . . -144.75 116.38 0.93 Allowed Glycine 0 CA--C 1.53 0.994 0 O-C-N 124.49 1.119 . . . . 1.3899999999999999 110.942 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.726 ' O ' ' CG ' ' A' ' 60' ' ' TYR . 0.5 OUTLIER -78.99 50.38 1.02 Allowed 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.474 0.749 . . . . 2.0299999999999998 111.03 179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.876 HG23 ' HB2' ' A' ' 18' ' ' TRP . 0.2 OUTLIER -84.54 -18.06 9.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 O-C-N 124.499 1.124 . . . . 2.9399999999999999 109.34 -179.999 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 110.79 10.54 20.97 Favored Glycine 0 CA--C 1.531 1.045 0 O-C-N 124.512 1.133 . . . . 3.4399999999999999 110.938 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.9 t -90.54 -77.76 0.4 Allowed 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.511 0.771 . . . . 3.1800000000000002 110.001 -179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.45 ' ND1' ' OD2' ' A' ' 39' ' ' ASP . 0.1 OUTLIER -89.72 25.91 1.91 Allowed 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.465 1.103 . . . . 3.0099999999999998 109.595 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.475 ' C ' ' CD2' ' A' ' 66' ' ' HIS . . . 76.14 -144.45 30.91 Favored Glycine 0 CA--C 1.53 0.993 0 O-C-N 124.483 1.114 . . . . 1.3300000000000001 110.95 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.565 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 0.2 OUTLIER -131.79 135.43 46.76 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.503 0.766 . . . . 1.1499999999999999 109.567 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.71 ' H ' ' NE2' ' A' ' 16' ' ' GLN . . . -38.82 128.95 1.56 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.547 1.154 . . . . 0.94999999999999996 109.277 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.565 ' N ' ' O ' ' A' ' 36' ' ' VAL . 2.1 ttt180 -77.34 -49.27 15.32 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.513 1.133 . . . . 5.9400000000000004 110.333 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.419 ' OH ' ' CB ' ' A' ' 5' ' ' SER . 13.0 p90 -176.01 173.48 2.25 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.535 1.147 . . . . 1.3300000000000001 111.031 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.802 ' CD2' HG23 ' A' ' 35' ' ' VAL . 7.7 mt -96.24 135.98 37.33 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.499 1.124 . . . . 0.95999999999999996 109.277 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.56 ' HB1' ' O ' ' A' ' 6' ' ' GLU . . . -117.18 163.37 16.39 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.461 1.101 . . . . 1.1799999999999999 109.317 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.473 ' HG3' ' CG ' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -114.81 136.85 52.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.522 1.139 . . . . 3.1499999999999999 110.249 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 1.014 ' SG ' ' SG ' ' A' ' 45' ' ' CYS . 1.4 t -78.41 -17.93 55.71 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.497 1.123 . . . . 1.9399999999999999 108.263 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HB2' ' NH1' ' A' ' 72' ' ' ARG . 4.6 mt . . . . . 0 C--O 1.25 1.105 0 CA-C-O 116.95 -1.5 . . . . 5.7999999999999998 109.325 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 N--CA 1.453 -0.3 0 N-CA-C 109.318 -0.623 . . . . 12.24 109.318 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.5 t -110.04 -38.16 5.39 Favored 'General case' 0 C--N 1.326 -0.437 0 O-C-N 124.479 1.112 . . . . 9.8699999999999992 110.413 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 2.5 m -144.24 108.55 4.81 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.513 1.133 . . . . 7.4900000000000002 110.423 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.658 HG13 ' N ' ' A' ' 5' ' ' SER . 1.1 p -68.21 -161.2 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 O-C-N 124.512 1.133 . . . . 6.9800000000000004 109.319 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.658 ' N ' HG13 ' A' ' 4' ' ' VAL . 0.2 OUTLIER 84.07 -73.61 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.497 1.123 . . . . 3.54 110.045 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.678 ' O ' ' HB1' ' A' ' 71' ' ' ALA . 0.1 OUTLIER 82.71 120.41 0.03 OUTLIER Pre-proline 0 C--N 1.325 -0.471 0 O-C-N 124.5 1.125 . . . . 3.3399999999999999 110.332 -179.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -74.99 139.52 24.41 Favored 'Trans proline' 0 C--N 1.36 1.172 0 O-C-N 124.531 1.806 . . . . 0.56000000000000005 111.013 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.493 ' HB1' ' HD2' ' A' ' 9' ' ' PRO . . . -53.83 164.07 1.0 Allowed Pre-proline 0 C--N 1.325 -0.499 0 O-C-N 124.491 1.12 . . . . 0.56999999999999995 109.34 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.493 ' HD2' ' HB1' ' A' ' 8' ' ' ALA . 18.1 Cg_endo -75.02 172.13 16.97 Favored 'Trans proline' 0 C--N 1.361 1.198 0 O-C-N 124.424 1.749 . . . . 0.72999999999999998 111.009 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 95.6 p -83.33 8.49 13.42 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 124.492 1.12 . . . . 2.3399999999999999 110.034 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.519 ' HB2' ' CA ' ' A' ' 27' ' ' CYS . 15.7 p -110.14 29.15 7.92 Favored 'General case' 0 C--N 1.326 -0.455 0 O-C-N 124.51 1.131 . . . . 1.0 108.315 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.402 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 83.1 t -145.18 114.94 1.67 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 124.496 1.123 . . . . 0.60999999999999999 109.326 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.6 142.62 28.44 Favored 'General case' 0 C--N 1.325 -0.468 0 O-C-N 124.53 1.144 . . . . 1.3600000000000001 110.362 -179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.686 HD21 ' HB3' ' A' ' 67' ' ' ALA . 20.1 tp -85.47 157.95 20.32 Favored 'General case' 0 C--N 1.325 -0.472 0 O-C-N 124.52 1.138 . . . . 1.1200000000000001 109.29 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 22' ' ' GLN . 0.1 OUTLIER -148.97 76.06 1.32 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.534 1.146 . . . . 1.6299999999999999 111.006 -179.977 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.409 ' HA ' ' OG ' ' A' ' 21' ' ' SER . 28.6 tt0 -79.93 141.5 35.99 Favored 'General case' 0 C--N 1.325 -0.478 0 O-C-N 124.475 1.11 . . . . 1.8999999999999999 110.296 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' SER . . . . . 0.473 ' O ' ' CD1' ' A' ' 60' ' ' TYR . 81.4 p -115.35 -128.24 0.29 Allowed 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.471 1.107 . . . . 1.78 109.984 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.67 ' HA ' ' CD1' ' A' ' 60' ' ' TYR . 41.2 p-90 -94.07 -68.4 0.8 Allowed 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.561 1.163 . . . . 5.3200000000000003 108.047 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.646 ' HB2' ' CE3' ' A' ' 18' ' ' TRP . 2.1 ttp180 -118.12 37.06 4.11 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.409 1.068 . . . . 9.1500000000000004 110.289 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.495 ' N ' ' O ' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -177.67 159.25 1.43 Allowed 'General case' 0 C--N 1.325 -0.495 0 O-C-N 124.564 1.165 . . . . 6.2400000000000002 110.977 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.597 ' CB ' ' HB2' ' A' ' 58' ' ' ASP . 40.4 m -131.77 166.25 21.96 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 124.464 1.102 . . . . 2.02 109.995 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.457 ' N ' ' O ' ' A' ' 15' ' ' TYR . 5.1 tt0 -138.85 140.83 38.6 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.466 1.104 . . . . 2.3199999999999998 110.311 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -105.07 123.26 47.5 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.534 1.147 . . . . 0.52000000000000002 109.339 179.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.604 ' HA ' HG23 ' A' ' 53' ' ' ILE . 1.7 t0 -100.17 120.28 39.63 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.499 1.124 . . . . 2.0800000000000001 109.303 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.705 ' HB2' HG12 ' A' ' 48' ' ' VAL . 20.2 t-20 -78.7 101.39 7.5 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.48 1.113 . . . . 0.79000000000000004 109.361 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.463 ' N ' ' O ' ' A' ' 11' ' ' CYS . . . -90.24 -0.52 76.86 Favored Glycine 0 CA--C 1.53 0.989 0 O-C-N 124.493 1.121 . . . . 0.69999999999999996 110.991 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' CYS . . . . . 0.519 ' CA ' ' HB2' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -85.32 -158.66 0.39 Allowed 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 108.295 -1.002 . . . . 1.5900000000000001 108.295 179.992 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.462 ' HA ' ' CB ' ' A' ' 50' ' ' PRO . . . -133.4 28.47 4.02 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.57 1.169 . . . . 1.0900000000000001 109.264 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.44 ' N ' ' HG3' ' A' ' 50' ' ' PRO . 0.0 OUTLIER -154.04 150.35 28.14 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.424 1.077 . . . . 3.25 110.309 -180.0 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.496 HG23 ' HA ' ' A' ' 49' ' ' ALA . 2.2 m -73.76 127.66 33.41 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.435 1.085 . . . . 0.93000000000000005 110.38 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 27.2 m -142.25 166.61 16.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 O-C-N 124.535 1.147 . . . . 0.81999999999999995 109.301 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.829 HG22 ' SG ' ' A' ' 45' ' ' CYS . 23.3 m -116.12 138.65 51.07 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.483 1.114 . . . . 0.91000000000000003 110.372 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.704 HG23 HD22 ' A' ' 70' ' ' LEU . 1.0 OUTLIER -141.97 172.5 9.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 O-C-N 124.521 1.138 . . . . 0.90000000000000002 109.267 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.753 ' HE2' ' HB3' ' A' ' 71' ' ' ALA . 0.0 OUTLIER -148.19 118.06 7.15 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.555 1.159 . . . . 2.4300000000000002 109.288 -179.988 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.819 HG11 ' OD2' ' A' ' 58' ' ' ASP . 0.4 OUTLIER -58.77 146.9 8.1 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.527 1.142 . . . . 0.73999999999999999 109.308 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.634 HG22 ' HG2' ' A' ' 42' ' ' GLU . 73.4 t -126.79 123.22 62.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 O-C-N 124.558 1.161 . . . . 0.66000000000000003 109.308 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.602 ' CE2' ' OD1' ' A' ' 58' ' ' ASP . 89.5 m-85 -74.29 163.0 28.34 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.467 1.105 . . . . 1.55 111.014 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.474 ' CG ' ' HG3' ' A' ' 68' ' ' ARG . 0.2 OUTLIER -62.52 -12.07 20.2 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.512 1.132 . . . . 3.5699999999999998 110.343 -179.998 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.467 ' O ' ' CB ' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -86.62 5.5 35.56 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.484 1.115 . . . . 1.8700000000000001 109.31 179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.467 ' CB ' ' O ' ' A' ' 39' ' ' ASP . 0.9 OUTLIER 80.08 -2.91 1.99 Allowed 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.453 1.096 . . . . 4.21 109.275 -179.987 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . 0.404 ' O ' ' HA ' ' A' ' 36' ' ' VAL . 1.2 p -80.11 172.81 13.28 Favored 'General case' 0 C--N 1.325 -0.497 0 O-C-N 124.516 1.135 . . . . 1.3 110.396 -179.993 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' GLU . . . . . 0.634 ' HG2' HG22 ' A' ' 36' ' ' VAL . 6.8 mt-10 -140.94 159.73 41.59 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.424 1.078 . . . . 1.8600000000000001 110.303 179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . 0.579 ' O ' HD23 ' A' ' 44' ' ' LEU . . . -89.79 -99.66 1.09 Allowed Glycine 0 CA--C 1.53 1.014 0 O-C-N 124.563 1.164 . . . . 1.9099999999999999 110.972 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.579 HD23 ' O ' ' A' ' 43' ' ' GLY . 54.6 mt -141.24 145.1 35.15 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.513 0.772 . . . . 1.6200000000000001 109.324 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.829 ' SG ' HG22 ' A' ' 32' ' ' THR . 0.7 OUTLIER -81.05 131.54 35.31 Favored 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.544 1.153 . . . . 1.8 108.302 -179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.751 ' HB2' HG12 ' A' ' 56' ' ' VAL . 28.8 m-85 -138.92 145.34 39.73 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.462 1.102 . . . . 2.02 110.969 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.47 ' HB2' ' OG1' ' A' ' 32' ' ' THR . . . -94.15 129.83 40.58 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.508 1.13 . . . . 0.56000000000000005 109.278 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.861 HG22 ' HB ' ' A' ' 54' ' ' THR . 50.9 t -124.79 144.93 33.0 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 O-C-N 124.489 1.118 . . . . 0.38 109.291 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.572 ' HB1' ' HD2' ' A' ' 50' ' ' PRO . . . -89.75 166.76 19.45 Favored Pre-proline 0 C--N 1.325 -0.486 0 O-C-N 124.541 1.151 . . . . 0.72999999999999998 109.315 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.572 ' HD2' ' HB1' ' A' ' 49' ' ' ALA . 18.2 Cg_endo -74.99 123.18 7.7 Favored 'Trans proline' 0 C--N 1.36 1.151 0 O-C-N 124.504 1.792 . . . . 1.05 111.013 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 89.01 21.74 41.16 Favored Glycine 0 CA--C 1.53 1.015 0 O-C-N 124.527 1.142 . . . . 1.1899999999999999 110.994 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.943 ' O ' HD13 ' A' ' 53' ' ' ILE . 0.0 OUTLIER -134.2 169.81 16.62 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.518 0.775 . . . . 2.8900000000000001 110.305 -179.951 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.943 HD13 ' O ' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -136.74 138.13 46.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 O-C-N 124.482 1.114 . . . . 1.1000000000000001 109.268 -179.995 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.861 ' HB ' HG22 ' A' ' 48' ' ' VAL . 0.4 OUTLIER -138.11 140.91 40.16 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 124.478 1.111 . . . . 0.94999999999999996 110.438 179.979 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' THR . . . . . 0.479 ' CG2' ' O ' ' A' ' 21' ' ' SER . 1.5 m -84.9 127.31 34.1 Favored 'General case' 0 C--N 1.325 -0.466 0 O-C-N 124.468 1.105 . . . . 1.49 110.387 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.751 HG12 ' HB2' ' A' ' 46' ' ' TYR . 3.9 m -101.75 -42.89 9.58 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 O-C-N 124.477 1.11 . . . . 2.6200000000000001 109.306 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.551 ' O ' ' CB ' ' A' ' 58' ' ' ASP . . . 138.79 159.4 8.03 Favored Glycine 0 CA--C 1.53 0.99 0 O-C-N 124.553 1.158 . . . . 2.46 110.985 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.819 ' OD2' HG11 ' A' ' 35' ' ' VAL . 2.4 m-20 152.03 -171.2 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.46 0.741 . . . . 6.4900000000000002 109.291 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.553 ' HA2' ' O ' ' A' ' 18' ' ' TRP . . . 174.73 118.46 0.52 Allowed Glycine 0 CA--C 1.531 1.032 0 O-C-N 124.495 1.122 . . . . 1.9099999999999999 111.008 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.67 ' CD1' ' HA ' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -101.9 11.75 38.08 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.507 0.769 . . . . 3.5299999999999998 111.057 179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ILE . . . . . 0.675 ' H ' HD13 ' A' ' 61' ' ' ILE . 0.2 OUTLIER -72.5 -5.19 5.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 O-C-N 124.5 1.125 . . . . 3.0899999999999999 109.265 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 118.18 2.09 16.03 Favored Glycine 0 CA--C 1.53 0.979 0 O-C-N 124.505 1.128 . . . . 2.73 111.016 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 3.8 m -60.14 -101.2 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.474 0 O-C-N 124.509 0.77 . . . . 3.4100000000000001 110.044 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.571 ' HB3' ' CD2' ' A' ' 37' ' ' TYR . 0.3 OUTLIER -91.92 27.91 1.98 Allowed 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.566 1.166 . . . . 3.5 109.631 179.948 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.425 ' O ' ' O ' ' A' ' 59' ' ' GLY . . . 84.31 -140.96 19.51 Favored Glycine 0 CA--C 1.53 0.969 0 O-C-N 124.507 1.129 . . . . 1.3400000000000001 111.009 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.48 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 1.3 m170 -126.68 131.61 51.37 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.45 0.735 . . . . 2.0600000000000001 109.634 179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.686 ' HB3' HD21 ' A' ' 14' ' ' LEU . . . -38.47 119.78 0.85 Allowed 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.438 1.086 . . . . 0.73999999999999999 109.284 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.474 ' HG3' ' CG ' ' A' ' 38' ' ' GLU . 7.6 ttp85 -78.69 -44.27 24.0 Favored 'General case' 0 C--N 1.324 -0.51 0 O-C-N 124.513 1.133 . . . . 5.1799999999999997 110.308 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.464 ' C ' ' CD1' ' A' ' 69' ' ' TYR . 7.8 p90 -176.43 167.88 2.76 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.517 1.135 . . . . 1.0 111.0 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.769 HD23 ' HA ' ' A' ' 35' ' ' VAL . 14.4 mt -101.2 147.29 26.44 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.533 1.146 . . . . 1.6100000000000001 109.329 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.753 ' HB3' ' HE2' ' A' ' 34' ' ' LYS . . . -131.33 149.04 52.72 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.524 1.14 . . . . 0.56999999999999995 109.267 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.467 ' CD ' ' HD3' ' A' ' 9' ' ' PRO . 0.0 OUTLIER -88.72 150.73 22.83 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.473 1.108 . . . . 3.71 110.277 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 8.5 m -115.06 137.03 52.47 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.49 1.118 . . . . 2.3100000000000001 108.301 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.899 HD12 ' OXT' ' A' ' 74' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.113 0 CA-C-O 117.0 -1.476 . . . . 5.1500000000000004 109.294 179.948 . . . . . . . . 2 2 . 1 stop_ save_